SCHEMBL8774963

SCHEMBL8774963

CCCCCCc1ccc(-c2cnc(Cl)c(Cl)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HSD17B10 Q99714 2/20 0.51
MEN1 O00255 2/20 0.51
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 2/20 0.51
KDM4E B2RXH2 1/20 0.51
USP2 O75604 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
NPC1 O15118 1/20 0.49
STAT3 P40763 1/20 0.49
ATM Q13315 1/20 0.49
TSHR P16473 1/20 0.48
RARB P10826 8/20 0.47
RARA P10276 2/20 0.47
MTOR P42345 1/20 0.47
KCNH2 Q12809 3/20 0.46
AKR1C2 P52895 1/20 0.45

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
SCHEMBL8774222 1.00 MAPT (0.51) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774115 0.98 RAB9A (0.49) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774724 0.94 AKR1C2 (0.50) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774882 0.88 RAB9A (0.41) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774251 0.86 RARB (0.53) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774831 0.86 RARB (0.53) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774917 0.85 RARB (0.51) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774263 0.84 MAPT (0.37) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774209 0.84 MAPT (0.37) MAPTRAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL8774260 0.84 MAPT (0.37) MAPTRAB9ASMN1; SMN2HSD17B10MEN1

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
EP-0519370-B1 Heterocyclic derivatives MERCK PATENT GMBH (DE) 1997-11-05 EP disclosed
EP-0519370-A2 Heterocyclic derivatives MERCK PATENT GmbH (DE) 1992-12-23 EP disclosed