SCHEMBL7330467

SCHEMBL7330467

OCc1cnc2sc3c(n12)CCCC3

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.51
ALDH1A1 P00352 5/20 0.51
HSD17B10 Q99714 3/20 0.51
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 2/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 2/20 0.51
GAA P10253 2/20 0.51
MAPK1 P28482 2/20 0.51
GLA P06280 1/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
DCTPP1 Q9H773 1/20 0.43
RXFP1 Q9HBX9 5/20 0.35
TP53 P04637 5/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
TSHR P16473 2/20 0.34

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
SCHEMBL7335315 0.98 MAPT (0.50) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7329395 0.98 MAPT (0.50) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7331586 0.97 MAPT (0.48) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7329661 0.73 MAPT (0.52) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7332194 0.71 MAPT (0.47) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7328558 0.71 MAPT (0.47) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7329865 0.71 MAPT (0.72) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7331948 0.70 MAPT (0.71) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7328454 0.70 MAPT (0.71) MAPTALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL7337989 0.69 MAPT (0.45) MAPTALDH1A1HSD17B10KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6191124-B1 VIRICIDES PHARMACIA & UPJOHN COMPANY 2001-02-20 US disclosed
EP-0757692-A1 METHANOL DERIVATIVES FOR TREATMENT OF RETROVIRAL INFECTIONS ESPECIALLY HIV INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1997-02-12 EP disclosed
WO-1995029922-A1 METHANOL DERIVATIVES FOR TREATMENT OF RETROVIRAL INFECTIONS ESPECIALLY HIV INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1995-11-09 WO disclosed