SCHEMBL30131336

SCHEMBL30131336

NC(=O)c1ncccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 2/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
BLM P54132 1/20 0.44
AGER Q15109 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PARP1 P09874 1/20 0.43
IKBKB O14920 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
CTNNB1 P35222 1/20 0.41
WNT3A P56704 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 2/20 0.40

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
SCHEMBL648916 1.00 SMN1; SMN2 (0.49) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
Formic Acid SCHEMBL2589657 0.93 SMN1; SMN2 (0.44) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL29535774 0.81 KDM4E (0.61) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL209954 0.81 KDM4E (0.61) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL29229156 0.81 KDM4E (0.45) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL3412671 0.81 ALDH1A1 (0.46) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL30644588 0.81 ALDH1A1 (0.42) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL365395 0.79 ALDH1A1 (0.45) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
SCHEMBL29229354 0.79 ALDH1A1 (0.44) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4
Hydrochloric Acid SCHEMBL5277146 0.79 KDM4E (0.59) SMN1; SMN2RAB9AALDH1A1KDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974774-B Preparation method and application of chloropicolinic acid 利尔化学股份有限公司 2024-09-03 CN claimed
CN-117715898-A Six-membered aryl or heteroaryl amide compound, composition and application thereof 贝达药业股份有限公司 2024-03-15 CN claimed
CN-115974774-A Preparation method and application of chloropyridine formic acid 利尔化学股份有限公司 2023-04-18 CN claimed
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 WO claimed
CN-119504731-A Naringenin derivative containing 1,3, 4-oxadiazole acylhydrazone structure and preparation method thereof 广东省科学院测试分析研究所(中国广州分析测试中心) 2025-02-25 CN disclosed
CN-115974774-B Preparation method and application of chloropicolinic acid 利尔化学股份有限公司 2024-09-03 CN disclosed
CN-117715898-A Six-membered aryl or heteroaryl amide compound, composition and application thereof 贝达药业股份有限公司 2024-03-15 CN disclosed
CN-115974774-A Preparation method and application of chloropyridine formic acid 利尔化学股份有限公司 2023-04-18 CN disclosed
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 WO disclosed