SCHEMBL9752608

SCHEMBL9752608

O=c1ccc(Cl)cn1CC(O)Cn1cc(Cl)ccc1=O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.38
RAD52 P43351 1/20 0.36
NLRP1 Q9C000 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
DHFR P00374 2/20 0.35
FABP6 P51161 1/20 0.35
PRMT5 O14744 4/20 0.35
ALDH1A1 P00352 3/20 0.34
OPRK1 P41145 1/20 0.34
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
WDR77 Q9BQA1 1/20 0.33

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
SCHEMBL2608967 0.81 MAPT (0.46) MAPTLMNASMN1; SMN2FABP6ALDH1A1
SCHEMBL7474420 0.74 MAPT (0.47) MAPTLMNASMN1; SMN2FABP6ALDH1A1
SCHEMBL15360158 0.74 MAPT (0.50) MAPTLMNASMN1; SMN2FABP6ALDH1A1
SCHEMBL7478784 0.73 MAPT (0.62) MAPTLMNASMN1; SMN2RAB9AALDH1A1
SCHEMBL10460692 0.71 MAPT (0.47) MAPTLMNASMN1; SMN2GAANPSR1
SCHEMBL1197644 0.70 KMO (0.50) MAPTLMNASMN1; SMN2FABP6ALDH1A1
SCHEMBL8784736 0.70 MAPT (0.51) MAPTLMNASMN1; SMN2GAARAB9A
SCHEMBL17221445 0.70 MAPT (0.51) MAPTLMNASMN1; SMN2GAAFABP6
SCHEMBL12530682 0.69 LMNA (0.48) MAPTLMNASMN1; SMN2HTTRAB9A
SCHEMBL9752577 0.68 POLB (0.46) RAD52NPSR1PRMT5POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991009848-A1 PYRIDINONES USEFUL AS ANTIATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1991-07-11 WO claimed
WO-1991009848-A1 PYRIDINONES USEFUL AS ANTIATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1991-07-11 WO disclosed