SCHEMBL10692239

SCHEMBL10692239

CCCCc1ccc[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.41
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
INCENP Q9NQS7 1/20 0.41
GPR84 Q9NQS5 2/20 0.40
CTRC Q99895 1/20 0.40
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
PARP1 P09874 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL2495417 0.94 GPR84 (0.46) DAOAURKAAURKBINCENPGPR84
SCHEMBL28243243 0.93 GPR84 (0.49) GPR84KDM4ETHRBNR1H2NR1H3
SCHEMBL10767574 0.93 GPR84 (0.49) GPR84KDM4ETHRBNR1H2NR1H3
SCHEMBL14974903 0.93 GPR84 (0.49) GPR84KDM4ETHRBNR1H2NR1H3
SCHEMBL27397512 0.93 GPR84 (0.49) GPR84KDM4ETHRBNR1H2NR1H3
SCHEMBL5166986 0.93 GPR84 (0.49) GPR84KDM4ETHRBNR1H2NR1H3
SCHEMBL10764266 0.93 GPR84 (0.49) GPR84KDM4ETHRBNR1H2NR1H3
SCHEMBL174911 0.88 KDM4E (0.44) DAOAURKAAURKBINCENPGPR84
SCHEMBL9234355 0.86 DAO (0.45) DAOAURKAAURKBINCENPGPR84
SCHEMBL797191 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250078176-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2025-03-06 US claimed
CN-118435582-A Environmental attributes of nitrogen-containing chemicals 巴斯夫欧洲公司 2024-08-02 CN claimed
WO-2023117926-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2023-06-29 WO claimed
US-20250078176-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2025-03-06 US disclosed
CN-118435582-A Environmental attributes of nitrogen-containing chemicals 巴斯夫欧洲公司 2024-08-02 CN disclosed
WO-2023117926-A1 ENVIRONMENTAL ATTRIBUTES FOR NITROGEN CONTAINING CHEMICALS BASF SE (DE) 2023-06-29 WO disclosed
CN-115778954-A Novel medical application of 2,2' -dipyridone hydrazone butyl dithioformate 新乡医学院 2023-03-14 CN disclosed
EP-3957603-A1 HIGH-SILICA Y MOLECULAR SIEVE HAVING FAU TOPOLOGY AND PREPARATION METHOD THEREFOR Dalian Institute of Chemical Physics, Chinese Academy of Sciences (CN) 2022-02-23 EP disclosed
WO-2019179928-A1 SUBSTITUTED SUCCINIMIDE-3-CARBOXAMIDES, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2019-09-26 WO disclosed
EP-0259048-A2 Chemical compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-03-09 EP disclosed