SCHEMBL9375306

SCHEMBL9375306

COC(=O)CCC(=O)c1ccccc1N

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.58
HSD17B10 Q99714 4/20 0.58
CFTR P13569 1/20 0.58
KDM4E B2RXH2 6/20 0.51
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 4/20 0.46
RCE1 Q9Y256 1/20 0.46
TSHR P16473 2/20 0.45
CTNNB1 P35222 1/20 0.43
WNT3A P56704 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL30852296 0.90 ALDH1A1 (0.54) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL1913618 0.90 ALDH1A1 (0.54) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL26800839 0.86 ALDH1A1 (0.61) ALDH1A1HSD17B10CFTRKDM4EMAPT
SCHEMBL6865172 0.83 ALDH1A1 (0.63) ALDH1A1HSD17B10CFTRKDM4EKMT2A
SCHEMBL31520096 0.83 ALDH1A1 (0.63) ALDH1A1HSD17B10CFTRKDM4EKMT2A
SCHEMBL5997550 0.83 ALDH1A1 (0.45) ALDH1A1HSD17B10CFTRKDM4EMAPT
SCHEMBL9637110 0.81 HSD17B10 (0.53) ALDH1A1HSD17B10CFTRKDM4ELMNA
SCHEMBL11581372 0.81 LMNA (0.56) ALDH1A1HSD17B10KDM4ELMNAMAPT
SCHEMBL20945673 0.79 ERCC5 (0.53) ALDH1A1HSD17B10KDM4ELMNAMAPT
SCHEMBL19283542 0.79 KDM4E (0.51) ALDH1A1HSD17B10KDM4ELMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230359119-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-09 US disclosed
EP-0353778-B1 Pyrrolo[1,4]benzodiazepine derivatives SHIONOGI & CO (JP) 1994-11-02 EP disclosed
US-4923984-A TREATMENT OF SENILE DEMENTIA, PSYCHONEUROSIS, AMNESIA SHIONOGI & CO., LTD. (JP) 1990-05-08 US disclosed
EP-0353778-A2 Pyrrolo[1,4]benzodiazepine derivatives SHIONOGI & CO., LTD. (JP) 1990-02-07 EP disclosed