SCHEMBL11655463

SCHEMBL11655463

Cc1cc(-c2cc3ccccc3[nH]2)ccc1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.49
NPC1 O15118 3/20 0.49
MAPT P10636 4/20 0.48
KDM4E B2RXH2 3/20 0.48
CASP3 P42574 2/20 0.48
SENP8 Q96LD8 2/20 0.48
SENP7 Q9BQF6 2/20 0.48
SENP6 Q9GZR1 2/20 0.48
MRGPRX4 Q96LA9 1/20 0.47
FFAR4 Q5NUL3 1/20 0.45
CYP1A2 P05177 2/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
CYP2D6 P10635 1/20 0.44
PRMT5 O14744 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL11657506 0.86 RAB9A (0.53) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL11655564 0.86 RAB9A (0.53) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL11654524 0.85 MAPT (0.51) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL11643565 0.85 MAPT (0.49) RAB9ANPC1MAPTKDM4ECASP3
Alcohol SCHEMBL11667570 0.82 PDE4A (0.52) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL11641323 0.82 NPC1 (0.49) RAB9ANPC1MAPTKDM4ECASP3
Acetone SCHEMBL11666554 0.81 SRD5A1 (0.52) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL11659391 0.81 KDM4E (0.63) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL11653431 0.80 ALOX15 (0.52) RAB9ANPC1MAPTKDM4ECASP3
SCHEMBL30751162 0.80 NPC1 (0.61) RAB9ANPC1MAPTKDM4ECASP3

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
US-4096112-A POLYVINYL CHLORIDE LABAZ (FR) 1978-06-20 US disclosed
US-4024155-A 2-(3'-Methoxy-4'-hydroxy-phenol)-indole LABAZ (FR) 1977-05-17 US disclosed