SCHEMBL5482159

SCHEMBL5482159

O=C(O)C1C=CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 4/20 0.33
NPC1 O15118 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
GRM4 Q14833 1/20 0.30

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
SCHEMBL11384229 0.98 KDM4E (0.34) POLBAPEX1TDP1RAB9ANPC1
SCHEMBL27951115 0.98 KDM4E (0.34) POLBAPEX1TDP1RAB9ANPC1
SCHEMBL17694211 0.98 KDM4E (0.34) POLBAPEX1TDP1RAB9ANPC1
SCHEMBL11384206 0.98 KDM4E (0.34) POLBAPEX1TDP1RAB9ANPC1
Hydrochloric Acid SCHEMBL10726052 0.98 POLB (0.33) POLBAPEX1TDP1RAB9ANPC1
SCHEMBL14398568 0.93
SCHEMBL28000893 0.93
SCHEMBL242415 0.93
SCHEMBL6932950 0.91 POLB (0.34) POLBAPEX1TDP1EGLN1
SCHEMBL6917077 0.91 POLB (0.34) POLBAPEX1TDP1EGLN1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103732059-A Nuclear hormone receptor modulators ABBOTT LAB 2014-04-16 CN claimed
US-5302602-A 5-HETEROCYCLO-ALKYL SUBSTITUTED DIBENZO (A,D) CYCLOHEPTENES KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-04-12 US claimed
CN-113896669-B Estrogen receptor modulators and uses thereof 海南先声再明医药股份有限公司 2024-12-17 CN disclosed
US-20230341777-A1 RESIST UNDERLAYER FILM-FORMING COMPOSITION CONTAINING TERMINAL-BLOCKED REACTION PRODUCT NISSAN CHEMICAL CORPORATION (JP) 2023-10-26 US disclosed
US-20230296984-A1 EUV RESIST UNDERLAYER FILM-FORMING COMPOSITION NISSAN CHEMICAL CORPORATION (JP) 2023-09-21 US disclosed
US-20230259028-A1 RESIST UNDERLAYER FILM-FORMING COMPOSITION CONTAINING REACTION PRODUCT OF HYDANTOIN COMPOUNDS NISSAN CHEMICAL CORPORATION (JP) 2023-08-17 US disclosed
CN-113896669-A Estrogen receptor modulators and uses thereof 江苏先声药业有限公司 2022-01-07 CN disclosed
CN-103732059-A Nuclear hormone receptor modulators ABBOTT LAB 2014-04-16 CN disclosed
EP-2685821-A1 NUCLEAR HORMONE RECEPTOR MODULATORS AbbVie Inc. (US) 2014-01-22 EP disclosed
WO-2012125797-A1 NUCLEAR HORMONE RECEPTOR MODULATORS ABBOTT LABORATORIES (US) 2012-09-20 WO disclosed
US-20070060592-A1 heterocylic amines such as 2-(5-{3-[4-(4-Chloro-2-methyl-phenyl)-piperazin-1-yl]-propylidene}-5,11-dihydro-10-oxa-1-aza-dibenzo[a,d]cyclohepten-7-yl)-propan-2-ol, used for treating diseases associated with aberrant leukocyte recruitment and/or activation MILLENNIUM PHARMACEUTICALS, INC. 2007-03-15 US disclosed
EP-1562954-A1 CCR1 ANTAGONISTS FOR THE TREATMENT OF I.A. DEMYELINATING INFLAMMATORY DISEASE MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-08-17 EP disclosed
EP-1448566-A2 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-08-25 EP disclosed
WO-2004043965-A1 CCR1 ANTAGONISTS FOR THE TREATMENT OF I.A. DEMYELINATING INFLAMMATORY DISEASE MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-05-27 WO disclosed
WO-2003045942-A2 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-06-05 WO disclosed
US-5302602-A 5-HETEROCYCLO-ALKYL SUBSTITUTED DIBENZO (A,D) CYCLOHEPTENES KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-04-12 US disclosed
EP-0351887-A1 Tricyclic aromatic compounds THE WELLCOME FOUNDATION LIMITED (GB) 1990-01-24 EP 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 (1 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-20070060592-A1 heterocylic amines such as 2-(5-{3-[4-(4-Chloro-2-methyl-phenyl)-piperazin-1-yl]-propylidene}-5,11-dihydro-10-oxa-1-aza-dibenzo[a,d]cyclohepten-7-yl)-propan-2-ol, used for treating diseases associated with aberrant leukocyte recruitment and/or activation THPO, NFATC1, HPGDS POLB 903/4885APEX1 1764/4885TDP1 1064/4885

“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.