SCHEMBL528652

SCHEMBL528652

COc1c(F)cccc1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
PARP10 Q53GL7 2/20 0.43
PARP15 Q460N3 1/20 0.43
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
BCHE P06276 1/20 0.42
JAK1 P23458 2/20 0.42
TYK2 P29597 2/20 0.42
KRAS P01116 2/20 0.41
RAB9A P51151 1/20 0.41
PARP1 P09874 3/20 0.41
ALB P02768 1/20 0.40
PARP14 Q460N5 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 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
Hydrochloric Acid SCHEMBL28262394 0.98 LMNA (0.43) LMNAHTTKMT2APARP10PARP15
SCHEMBL3395132 0.86 PARP1 (0.47) KMT2APARP10NPC1SMN1; SMN2RAB9A
SCHEMBL28266600 0.85 CES2 (0.45) KMT2ANPC1SMN1; SMN2CES2CES1
SCHEMBL1261333 0.83 KMT2A (0.50) LMNAKMT2ANPC1SMN1; SMN2CES2
SCHEMBL29933044 0.83 ALB (0.55) HTTKMT2ANPC1SMN1; SMN2CES2
SCHEMBL184046 0.83 ALB (0.55) HTTKMT2ANPC1SMN1; SMN2CES2
SCHEMBL27675594 0.82 KMT2A (0.48) KMT2ANPC1SMN1; SMN2RAB9AKDM4E
SCHEMBL24916 0.81 ALDH1A1 (0.57) KMT2ANPC1SMN1; SMN2CES2CES1
SCHEMBL4135906 0.81 F10 (0.41) KMT2ANPC1SMN1; SMN2CES2CES1
SCHEMBL5444249 0.81 TSHR (0.48) LMNAKMT2ANPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO claimed
EP-1928465-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING HEPATITIS C INFECTION Arrow Therapeutics Limited (GB) 2008-06-11 EP claimed
CN-1309715-C N-acylaminoacetonitrile derivatives and their use for controlling parasites NOVARTIS AG (CH) 2007-04-11 CN claimed
WO-2007034127-A1 BENZODIAZEPINE DERIVATIVES FOR TREATING HEPATITIS C INFECTION ARROW THERAPEUTICS LIMITED (GB) 2007-03-29 WO claimed
WO-2025078808-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2025-04-17 WO disclosed
CN-118044519-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-05-17 CN disclosed
CN-110072842-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-02-02 CN disclosed
CN-114634512-B Compounds as inhibitors of bruton's tyrosine kinase, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2023-11-14 CN disclosed
WO-2023165570-A1 CYCLOALKYL OR HETEROCYCLYL SUBSTITUTED HETEROARYL COMPOUND, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2023-09-07 WO disclosed
US-20230192691-A1 HETEROCYCLIC COMPOUNDS AS BTK INHIBITORS BEIJING INNOCARE PHARMA TECH CO LTD (CN) 2023-06-22 US disclosed
US-11618753-B2 Aminopyrrolotriazines as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2023-04-04 US disclosed
CN-114716381-A Compounds useful as kinase inhibitors 洛克索肿瘤学股份有限公司 2022-07-08 CN disclosed
CN-101360498-A Calcilytic compounds SMITHKLINE BEECHAM CORP (US) 2009-02-04 CN disclosed
EP-1951244-A2 CALCILYTIC COMPOUNDS SmithKline Beecham Corporation (US) 2008-08-06 EP disclosed
WO-2007062370-A2 CALCILYTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 WO disclosed
WO-2007062370-A2 CALCILYTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-05-31 WO disclosed
CN-1309715-C N-acylaminoacetonitrile derivatives and their use for controlling parasites NOVARTIS AG (CH) 2007-04-11 CN disclosed
CN-1602296-A Amidoacetonitrile derivatives NOVARTIS AG (CH) 2005-03-30 CN disclosed
CN-1046939-C Fluoroalkoxy-substituted benzamides and their use as cyclic nucleotide phosphodiesterase inhibitors BYK GULDEN LOMBERG CHEM FAB (DE) 1999-12-01 CN disclosed
CN-1126468-A Fluoroalkoxy-substituted benzamides and their use as cyclic nucleotide phosphodiesterase inhibitors BYK GULDEN LOMBERG CHEM FAB (DE) 1996-07-10 CN 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-20230192691-A1 HETEROCYCLIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LYN LMNA 3949/4885HTT 1747/4885KMT2A 1636/4885
US-11618753-B2 Aminopyrrolotriazines as kinase inhibitors RIPK1, RIPK2, RIPK4 LMNA 3691/4885HTT 4188/4885KMT2A 3048/4885

“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.