SCHEMBL158686

SCHEMBL158686

CCOC(=O)c1cncc(Br)c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.70
CYP2C9 P11712 1/20 0.70
SMN1; SMN2 Q16637 4/20 0.63
CYP1A2 P05177 2/20 0.62
CYP3A4 P08684 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
POLB P06746 2/20 0.59
TSHR P16473 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
HSD17B10 Q99714 1/20 0.59
GAA P10253 1/20 0.58
PKM P14618 1/20 0.58
HCAR2 Q8TDS4 1/20 0.56
MAPT P10636 2/20 0.56
ATM Q13315 1/20 0.56
HTT P42858 1/20 0.55

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
SCHEMBL29597594 1.00 CYP2C19 (0.70) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
SCHEMBL30214356 0.94 CYP2C19 (0.82) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
SCHEMBL277284 0.89 CYP2C19 (0.86) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL9679507 0.87 CYP2C19 (0.83) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
SCHEMBL18536755 0.86 MAPT (0.64) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6830767 0.84 L3MBTL1 (0.57) CYP2C19SMN1; SMN2CYP1A2CYP3A4L3MBTL1
SCHEMBL6979199 0.84 CYP2C19 (0.72) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
SCHEMBL13296375 0.83 MAPT (0.76) CYP2C19SMN1; SMN2CYP1A2CYP3A4L3MBTL1
SCHEMBL8622944 0.83 CYP2C19 (0.57) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4
SCHEMBL14017822 0.83 CYP2C19 (0.57) CYP2C19CYP2C9SMN1; SMN2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107981492-B Preparation method of amber pendant 钟杰 2020-06-19 CN claimed
CN-103012451-A Industrialized preparation method of 3-ethoxycarbonyl-5-pyridine pinacol borate WUXI APPTEC CO LTD 2013-04-03 CN claimed
EP-0767792-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-11-20 EP claimed
EP-0767792-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-04-16 EP claimed
WO-1996000730-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-01-11 WO claimed
EP-4747247-A1 NOVEL FATTY ACID AMIDE HYDROLASE MODULATORS, COMPOSITIONS COMPRISING THE SAME AND USES THEREOF Apogee Pharmaceuticals, Inc. (CA) 2026-05-27 EP disclosed
EP-3364967-B1 FERROPORTIN INHIBITORS VIFOR INT AG (CH) 2026-05-20 EP disclosed
EP-3710428-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-25 EP disclosed
CN-121554416-A Preparation process of 5-bromonicotinic acid 嘉兴佰美济华医药科技有限公司 2026-02-24 CN disclosed
WO-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 WO disclosed
US-12421193-B2 GPR52 modulators and methods of use NEUROCRINE BIOSCIENCES, INC. (US) 2025-09-23 US disclosed
US-12410137-B2 Fatty acid amide hydrolase modulators, compositions comprising the same and uses thereof APOGEE PHARMACEUTICALS, INC. (CA) 2025-09-09 US disclosed
US-5559124-A QUINUCLIDINE DERIVATIVE TARGACEPT, INC., A CORPORATION OF DELAWARE 1996-09-24 US disclosed
WO-1996023783-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1996-08-08 WO disclosed
WO-1996015123-A1 PYRIDINE MODULATORS OF ACETYLCHOLINE RECEPTORS SIBIA NEUROSCIENCES, INC. (US) 1996-05-23 WO disclosed
US-5510355-A ADMINISTERING 2-(3-PYRIDYL)-QUINUCLILIDINE DERIVATIVE TO THE PATIENT UNDERGOING SURGICAL PROCEDURE REQUIRING ANESTHESIA AS A MUSCLE RELEXANT TARGACEPT, INC., A CORPORATION OF DELAWARE 1996-04-23 US disclosed
WO-1996007410-A2 DEPOLARIZING SKELETAL MUSCLE RELAXANTS R.J. REYNOLDS TOBACCO COMPANY (US) 1996-03-14 WO disclosed
EP-0656897-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1995-06-14 EP disclosed
WO-1994005660-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1994-03-17 WO disclosed
EP-0127276-A2 Carbonylation process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-12-05 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 (2 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-12410137-B2 Fatty acid amide hydrolase modulators, compositions comprising the same and uses thereof FAAH, FAAH2, MGLL CYP2C19 575/4885CYP2C9 425/4885SMN1; SMN2 4636/4885
US-12421193-B2 GPR52 modulators and methods of use GPR52, GPR68, GPR35 CYP2C19 2391/4885CYP2C9 3244/4885SMN1; SMN2 696/4885

“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.