SCHEMBL326359

SCHEMBL326359

C[U](C)(C)(C)n1nnc2cccnc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39
▸ TUBB3 Q13509 1/20 0.39
▸ TUBB2A Q13885 1/20 0.39
▸ TUBB8 Q3ZCM7 1/20 0.39
▸ TUBA3E Q6PEY2 1/20 0.39
▸ TUBA1A Q71U36 1/20 0.39
▸ TUBA1C Q9BQE3 1/20 0.39
▸ TUBB6 Q9BUF5 1/20 0.39
▸ TUBB2B Q9BVA1 1/20 0.39
▸ TUBB1 Q9H4B7 1/20 0.39
▸ FAAH O00519 3/20 0.38
▸ MGLL Q99685 3/20 0.38
▸ RAB9A P51151 4/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20235835 0.93 TUBB4A (0.36) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL31289323 0.75 SLC9A1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8256698 0.75 SLC9A1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL1226224 0.71 POLB (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL19957621 0.71 TUBB4A (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25400045 0.71 FAAH (0.39) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5393 0.71 POLB (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL537916 0.71 FAAH (0.42) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL16879491 0.71 ALDH1A1 (0.50) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Potassium Ion SCHEMBL29403001 0.71 FAAH (0.39) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216337-A1 ALPHA2 ADRENERGIC AGONIST CODRUGS CONJUGATED WITH MUSCARINIC AGONIST DRUGS ADS THERAPEUTICS LLC 2024-07-04 — — US disclosed
US-20240199592-A1 CHROMENE DERIVATIVES AS INHIBITORS OF TCR-NCK INTERACTION ARTAX BIOPHARMA INC. 2024-06-20 — — US disclosed
US-11999742-B2 Substituted pyrrolo[1,2-b]pyridazines as anthelmintics BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2024-06-04 — — US disclosed
CN-117500497-A Alpha 2 adrenergic agonist complex coupled to muscarinic agonist ADS医疗有限责任公司 2024-02-02 — — CN disclosed
EP-4304585-A2 METHYL-SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS OF THEIR USE Latigo Biotherapeutics, Inc. (US) 2024-01-17 — — EP disclosed
CN-117062607-A Methyl substituted pyridine and pyridazine compounds, derivatives thereof and methods of use thereof 拉堤果生物医疗股份有限公司 2023-11-14 — — CN disclosed
US-11807633-B2 Chromene derivatives as inhibitors of TCR-Nck interaction ARTAX BIOPHARMA INC. (US) 2023-11-07 — — US disclosed
US-RE49699-E1 Inhibitors of TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-10-17 — — US disclosed
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2023-09-21 — — US disclosed
US-20230159543-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2023-05-25 — — US disclosed
WO-2012006202-A1 RHO KINASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-12 — — WO disclosed
WO-2011127405-A9 METHODS AND COMPOSITIONS FOR ENHANCED DELIVERY OF COMPOUNDS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-11-17 — — WO disclosed
WO-2011127405-A1 METHODS AND COMPOSITIONS FOR ENHANCED DELIVERY OF COMPOUNDS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-10-13 — — WO disclosed
US-20110021524-A1 COMPOSITIONS AND METHODS FOR TREATING CANCERS IRM LLC (BM) 2011-01-27 — — US disclosed
US-20100216791-A1 PYRIDINYLQUINAZOLINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA (SE) 2010-08-26 — — US disclosed
WO-2010045503-A1 BORON-CONTAINING SMALL MOLECULES AS ANTI-PROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. (US) 2010-04-22 — — WO disclosed
WO-2010045505-A1 BORON-CONTAINING SMALL MOLECULES AS ANTI-PROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC (US) 2010-04-22 — — WO disclosed
EP-2114928-A2 THIOPHENE CARBOXAMIDES AS FACTOR XA INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2009-11-11 — — EP disclosed
US-7411065-B2 Peptide nucleic acid monomers: diphenylmethyl, benzyl, alkylthioalkyl, or phenylthioalkyl esters of N-(1-[4-(2-benzothiazolyl-, 2-benzoxazolyl-, 2-benzofuranyl- or 2-benzothiophenyl-sulfonyl)-3-piperazinon-1-ylcarbonylmethyl]pyrimidon-4-yl)carbamic acids PANAGENE, INC. (KR) 2008-08-12 — — US disclosed
WO-2008086188-A2 THIOPHENE CARBOXAMIDES AS FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-07-17 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240199592-A1 CHROMENE DERIVATIVES AS INHIBITORS OF TCR-NCK INTERACTION NCK1, NCKAP1, NCKAP1L TUBB4A 1663/4885TUBB 1126/4885TUBA3C 998/4885
US-20100216791-A1 PYRIDINYLQUINAZOLINAMINE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS BRAF, RAF1, ARAF TUBB4A 1986/4885TUBB 1473/4885TUBA3C 2356/4885
US-11807633-B2 Chromene derivatives as inhibitors of TCR-Nck interaction NCK1, NCKAP1, NCKAP1L TUBB4A 1663/4885TUBB 1126/4885TUBA3C 998/4885
US-20240216337-A1 ALPHA2 ADRENERGIC AGONIST CODRUGS CONJUGATED WITH MUSCARINIC AGONIST DRUGS ADRB2, ADRA2A, ADRA2B TUBB4A 428/4885TUBB 344/4885TUBA3C 501/4885
US-20110021524-A1 COMPOSITIONS AND METHODS FOR TREATING CANCERS ABL1, BCR, MCL1 TUBB4A 430/4885TUBB 383/4885TUBA3C 817/4885
US-20230159543-A1 ANTHELMINTIC PYRROLOPYRIDAZINE COMPOUNDS IL5, EPX, MPO TUBB4A 317/4885TUBB 174/4885TUBA3C 91/4885
US-20230295112-A1 HETEROAROMATIC COMPOUNDS AS VANIN INHIBITORS VHL, FANCI, PAH TUBB4A 3606/4885TUBB 3588/4885TUBA3C 3954/4885
US-11999742-B2 Substituted pyrrolo[1,2-b]pyridazines as anthelmintics IL5, PLPBP, PNPO TUBB4A 203/4885TUBB 22/4885TUBA3C 70/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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