SCHEMBL15978622

SCHEMBL15978622

Nc1ccc(F)c(Cl)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
KEAP1 Q14145 1/20 0.41
POLB P06746 2/20 0.37
ALDH1A1 P00352 1/20 0.37
DPP4 P27487 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 3/20 0.35
GFER P55789 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
MEN1 O00255 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
PKM P14618 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
MCL1 Q07820 1/20 0.34

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
SCHEMBL913402 0.84 CYP3A4 (0.41) CYP3A4KEAP1POLBALDH1A1DPP4
SCHEMBL2334297 0.83 DPP4 (0.41) KEAP1ALDH1A1DPP4ALOX15TSHR
SCHEMBL21750024 0.81 KEAP1 (0.45) KEAP1POLBALDH1A1KMT2AKDM4E
SCHEMBL7015064 0.79 DPP4 (0.48) CYP3A4KEAP1POLBALDH1A1DPP4
SCHEMBL2203971 0.79 KEAP1 (0.44) KEAP1POLBALDH1A1KMT2AKDM4E
SCHEMBL1358784 0.79 DPP4 (0.54) ALDH1A1DPP4ALOX15TSHRKDM4E
SCHEMBL21435217 0.78 ABL1 (0.47) POLBALDH1A1ALOX15TSHRKMT2A
Potassium SCHEMBL30811378 0.78 DPP4 (0.52) ALDH1A1DPP4ALOX15TSHRKDM4E
SCHEMBL29181700 0.78 DPP4 (0.52) ALDH1A1DPP4ALOX15TSHRKDM4E
SCHEMBL3574434 0.78 DPP4 (0.47) KEAP1POLBALDH1A1DPP4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12447151-B2 Alkyne derivative, preparation method for same, and uses thereof HIS PHARMACEUTICAL CO., LTD. (CN) 2025-10-21 US disclosed
EP-4359415-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-05-01 EP disclosed
CN-115785084-B Pyrimidine derivatives and their use in medicine 广东东阳光药业股份有限公司 2024-01-16 CN disclosed
CN-114072409-B Alkyne derivative and preparation method and application thereof 浙江海正药业股份有限公司 2023-07-28 CN disclosed
CN-115785084-A Pyrimidine derivatives and their use in medicine 广东东阳光药业有限公司 2023-03-14 CN disclosed
WO-2022271684-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed
WO-2022271684-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed
US-20220257602-A1 ALKYNE DERIVATIVE, PREPARATION METHOD FOR SAME, AND USES THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2022-08-18 US disclosed
CN-114685395-A 2, 3-dihydrobenzo [ d ] isothiazole compound and application thereof 浙江大学 2022-07-01 CN disclosed
EP-3998270-A1 ALKYNE DERIVATIVE, PREPARATION METHOD FOR SAME, AND USES THEREOF Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) 2022-05-18 EP disclosed
US-10899769-B2 Imidazopiperazinone inhibitors of transcription activating proteins BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-01-26 US disclosed
EP-3619205-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2020-03-11 EP disclosed
US-20190308978-A1 IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-10-10 US disclosed
WO-2019195846-A1 IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-10-10 WO disclosed
WO-2019195846-A1 IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-10-10 WO disclosed
US-20190308978-A1 IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-10-10 US disclosed
WO-2018203235-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2018-11-08 WO disclosed
US-20180105527-A1 HETEROARYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSTION FOR PREVENTING OR TREATING DISEASES ASSOCIATED WITH PI3 KINASES, CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2018-04-19 US disclosed
US-20180105527-A1 HETEROARYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSTION FOR PREVENTING OR TREATING DISEASES ASSOCIATED WITH PI3 KINASES, CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2018-04-19 US disclosed
WO-2014128612-A1 QUINAZOLIN-4-ONE DERIVATIVES NOVARTIS AG (CH) 2014-08-28 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 (5 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-20220257602-A1 ALKYNE DERIVATIVE, PREPARATION METHOD FOR SAME, AND USES THEREOF PIK3CD, PIK3R5, PIK3CA CYP3A4 1650/4885KEAP1 3507/4885POLB 2816/4885
US-20180105527-A1 HETEROARYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSTION FOR PREVENTING OR TREATING DISEASES ASSOCIATED WITH PI3 KINASES, CONTAINING SAME AS ACTIVE INGREDIENT WEE2, WEE1, ITK CYP3A4 922/4885KEAP1 2088/4885POLB 3532/4885
US-10899769-B2 Imidazopiperazinone inhibitors of transcription activating proteins EP300, CREBBP, RBBP4 CYP3A4 4616/4885KEAP1 1097/4885POLB 1093/4885
US-12447151-B2 Alkyne derivative, preparation method for same, and uses thereof PIK3CD, PIK3R5, PIK3CA CYP3A4 1650/4885KEAP1 3507/4885POLB 2816/4885
US-20190308978-A1 IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS EP300, CREBBP, RBBP4 CYP3A4 4616/4885KEAP1 1097/4885POLB 1093/4885

“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.