SCHEMBL66512

SCHEMBL66512

O=S(=O)(Cl)CCc1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.50
TAAR1 Q96RJ0 4/20 0.46
HTR2A P28223 2/20 0.42
KCNH2 Q12809 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
HTR2C P28335 1/20 0.41
MAOB P27338 1/20 0.41
PTGES2 Q9H7Z7 2/20 0.40
PRKCA P17252 1/20 0.40
GSK3B P49841 1/20 0.40
AOC3 Q16853 1/20 0.39
RECQL P46063 1/20 0.39
IDO1 P14902 1/20 0.39

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
SCHEMBL14427173 0.94 MAOB (0.50) APLNRTAAR1HTR2AKCNH2CA12
SCHEMBL2441516 0.82 TAAR1 (0.50) TAAR1HTR2AKCNH2CA12CA1
SCHEMBL105528 0.80 TAAR1 (0.48) TAAR1CA12CA1CA2CA4
SCHEMBL27825383 0.80 TAAR1 (0.48) TAAR1HTR2AKCNH2CA12CA1
SCHEMBL29001390 0.80 MGLL (0.48) TAAR1HTR2AKCNH2CA12CA1
SCHEMBL2377606 0.78 TAAR1 (0.46) APLNRTAAR1HTR2ACA12CA1
SCHEMBL778326 0.78 TAAR1 (0.46) TAAR1HTR2AKCNH2CA12CA1
SCHEMBL20495284 0.78 PTGS2 (0.47) TAAR1HTR2AKCNH2CA12CA1
SCHEMBL4769306 0.78 RECQL (0.64) TAAR1CA12CA1CA2CA4
SCHEMBL4702032 0.78 KMT2A (0.49) TAAR1CA12CA1CA2PTGES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326713-A1 INHIBITORS OF MsbA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2025-10-23 US disclosed
EP-4525852-A1 INHIBITORS OF MSBA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Merck Sharp & Dohme LLC (US) 2025-03-26 EP disclosed
US-20250066341-A1 CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2025-02-27 US disclosed
US-20240245699-A1 PYRROLE COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2024-07-25 US disclosed
WO-2023224893-A1 INHIBITORS OF MSBA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-11-23 WO disclosed
US-20210290631-A1 PYRROLE COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2021-09-23 US disclosed
US-11058689-B2 Pyrrole compounds, a process for their preparation and pharmaceutical LES LABORATOIRES SERVIER (FR) 2021-07-13 US disclosed
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AMGEN INC. (US) 2021-06-29 US disclosed
EP-3541792-B1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2020-12-23 EP disclosed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
EP-1390034-A1 N-SUBSTITUTED NONARYL-HETEROCYCLO AMIDYL NMDA/NR2B ANTAGONISTS Merck & Co., Inc. (US) 2004-02-25 EP disclosed
EP-1379520-A1 N-SUBSTITUTED NONARYL-HETEROCYCLIC NMDA/NR2B ANTAGONISTS Merck & Co., Inc. (US) 2004-01-14 EP disclosed
US-6670362-B2 Treatment of restenosis, acute or chronic renal failure, pulmonary hypertension, systemic hypertension, benign prostatic hyperplasia, male erectile dysfunction, prostate cancer, metastatic bone cancer, angina, atherosclerosis PFIZER INC. 2003-12-30 US disclosed
US-20030119811-A1 N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists MERCK SHARP & DOHME CORP. 2003-06-26 US disclosed
WO-2002100352-A2 NR2B RECEPTOR ANTAGONISTS FOR THE TREATMENT OR PREVENTION OF MIGRAINES MERCK & CO., INC. (US) 2002-12-19 WO disclosed
US-20020165241-A1 N-substituted nonaryl-heterocyclic NMDA/NR2B antagonists MERCK SHARP & DOHME LLC 2002-11-07 US disclosed
WO-2002080928-A1 N-SUBSTITUTED NONARYL-HETEROCYCLO AMIDYL NMDA/NR2B ANTAGONISTS MERCK & CO., INC. (US) 2002-10-17 WO disclosed
WO-2002068409-A1 N-SUBSTITUTED NONARYL-HETEROCYCLIC NMDA/NR2B ANTAGONISTS MERCK & CO., INC. (US) 2002-09-06 WO disclosed
US-20020061889-A1 New pyridazine endothelin antagonists PFIZER INC. 2002-05-23 US disclosed
EP-1191026-A1 New pyridazine endothelin antagonists Pfizer Limited (GB) 2002-03-27 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 (9 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-11058689-B2 Pyrrole compounds, a process for their preparation and pharmaceutical PDCD11, RRM2B, RRS1 APLNR 1498/4885TAAR1 1311/4885HTR2A 3165/4885
US-20210290631-A1 PYRROLE COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PDCD11, RRM2, RRM2B APLNR 1430/4885TAAR1 1716/4885HTR2A 3109/4885
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AGTR1, AGTR2, TBXA2R APLNR 13/4885TAAR1 207/4885HTR2A 300/4885
US-20240245699-A1 PYRROLE COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PDCD11, RRM2B, RRM2 APLNR 1488/4885TAAR1 1758/4885HTR2A 3113/4885
US-20020061889-A1 New pyridazine endothelin antagonists EDNRB, EDNRA, ECE1 APLNR 86/4885TAAR1 61/4885HTR2A 65/4885
US-20250326713-A1 INHIBITORS OF MsbA AS ANTIBIOTICS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MSRB3, ARSA, ABCG2 APLNR 4691/4885TAAR1 3599/4885HTR2A 3183/4885
US-20250066341-A1 CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS LPAR1, LPAR2, LPAR3 APLNR 179/4885TAAR1 176/4885HTR2A 1522/4885
US-20030119811-A1 N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists GRIN1, GRIN2B, GRIN2A APLNR 225/4885TAAR1 323/4885HTR2A 234/4885
US-20020165241-A1 N-substituted nonaryl-heterocyclic NMDA/NR2B antagonists GRIN1, GRIN2B, GRIN2A APLNR 323/4885TAAR1 327/4885HTR2A 216/4885

“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.