SCHEMBL10691265

SCHEMBL10691265

CCCCCCCCc1cnc(-c2ccc(OCc3ccc(OCCCCCC)cc3)cc2)nc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
MAPT P10636 4/20 0.57
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 4/20 0.57
HPGD P15428 3/20 0.57
HSD17B10 Q99714 2/20 0.57
MEN1 O00255 2/20 0.57
USP2 O75604 2/20 0.57
KMT2A Q03164 2/20 0.57
GAA P10253 1/20 0.57
RARB P10826 4/20 0.56
NPC1 O15118 4/20 0.56
L3MBTL1 Q9Y468 2/20 0.53
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
STAT3 P40763 1/20 0.48
ATM Q13315 1/20 0.48

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
SCHEMBL10691219 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10693704 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10694257 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10693058 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10689030 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10691945 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10693947 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10695948 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10693526 1.00 RAB9A (0.57) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL10693812 0.99 RAB9A (0.58) RAB9ASMN1; SMN2MAPTKDM4EALDH1A1

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-4776973-A LIQUID CRYSTAL ELECTROOPTICS DISPLAY DEVICE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-10-11 US disclosed