SCHEMBL8774115

SCHEMBL8774115

CCCCCc1ccc(-c2cnc(Cl)c(Cl)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.49
MAPT P10636 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HSD17B10 Q99714 2/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
USP2 O75604 1/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
NPC1 O15118 3/20 0.47
STAT3 P40763 1/20 0.47
ATM Q13315 1/20 0.47
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46

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
SCHEMBL8774963 0.98 MAPT (0.51) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774222 0.98 MAPT (0.51) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774724 0.95 AKR1C2 (0.50) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774882 0.89 RAB9A (0.41) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774917 0.86 RARB (0.51) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774251 0.85 RARB (0.53) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774831 0.85 RARB (0.53) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774662 0.84 RAB9A (0.46) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774201 0.83 AKR1C2 (0.36) RAB9AMAPTSMN1; SMN2HSD17B10MEN1
SCHEMBL8774205 0.83 AKR1C2 (0.36) RAB9AMAPTSMN1; 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