SCHEMBL7846115

SCHEMBL7846115

COCCOCCN(Cc1ccc(Cl)cc1)C(=O)c1c[nH]c2ccc(C#CCO)cc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.42
KMT2A Q03164 1/20 0.42
CFTR P13569 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
HPGD P15428 1/20 0.38
PYGL P06737 1/20 0.38
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRA3 P34903 1/20 0.36

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
SCHEMBL7841391 0.93 CFTR (0.41) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7858072 0.89 HSD17B10 (0.46) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7834426 0.88 HSD17B10 (0.46) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7833923 0.87 CFTR (0.45) CFTRKDM4EALDH1A1GLAHPGD
SCHEMBL7845316 0.87 HSD17B10 (0.44) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7847436 0.87 KDM4E (0.44) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7842246 0.86 KDM4E (0.44) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7845731 0.85 HSD17B10 (0.44) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7845109 0.85 CFTR (0.42) HSD17B10KMT2ACFTRKDM4EALDH1A1
SCHEMBL7846548 0.85 CFTR (0.42) CFTRKDM4EALDH1A1GLAHPGD

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
EP-1140850-A1 QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-10 EP claimed
WO-2000040561-A1 QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-07-13 WO claimed
EP-1140850-A1 QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-10 EP disclosed
WO-2000040561-A1 QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-07-13 WO disclosed