SCHEMBL11246384

SCHEMBL11246384

O=C(O)CCCCCCn1c(-c2ccc(Cl)cc2)c[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP2C9 P11712 1/20 0.47
POLB P06746 1/20 0.44
TSHR P16473 1/20 0.44
APEX1 P27695 1/20 0.44
HSD17B10 Q99714 1/20 0.44
FABP4 P15090 4/20 0.43
FABP5 Q01469 2/20 0.43
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41

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
SCHEMBL11255916 0.88 FABP4 (0.54) ALDH1A1KDM4ETSHRAPEX1HSD17B10
SCHEMBL11255610 0.88 FABP4 (0.54) ALDH1A1KDM4ETSHRAPEX1HSD17B10
SCHEMBL11258884 0.88 FABP4 (0.54) ALDH1A1KDM4ETSHRAPEX1HSD17B10
SCHEMBL11267074 0.88 FABP4 (0.54) ALDH1A1KDM4ETSHRAPEX1HSD17B10
SCHEMBL11125777 0.86 FABP4 (0.52) ALDH1A1KDM4ETSHRHSD17B10FABP4
SCHEMBL11259084 0.84 KDM4E (0.48) ALDH1A1HPGDKDM4ECYP2C9POLB
SCHEMBL11258178 0.82 APEX1 (0.52) ALDH1A1HPGDKDM4ECYP2C9POLB
SCHEMBL9768675 0.77 ALDH1A1 (0.48) ALDH1A1HPGDKDM4ECYP2C9POLB
SCHEMBL11125773 0.76 HDAC1 (0.41) ALDH1A1HPGDKDM4EHSD17B10FABP4
SCHEMBL11256522 0.76 PDE4A (0.41) ALDH1A1HPGDKDM4EPOLBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4330550-A ANTICOAGULANTS AND ANALGESICS A. NATTERMANN & CIE. GMBH (DE) 1982-05-18 US claimed