SCHEMBL9315420

SCHEMBL9315420

COc1ccc2[nH]ccc2c1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.47
BCHE P06276 7/20 0.46
HTR1A P08908 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ELANE P08246 1/20 0.41
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RHEB Q15382 1/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41

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
SCHEMBL3897534 0.89 POLB (0.43) MITFLMNAMAPTMAPK1KMT2A
SCHEMBL9314498 0.87 POLB (0.46) LMNAKMT2APOLBHTR1AADRA1D
SCHEMBL30483750 0.82 POLB (0.52) LMNAMAPTMAPK1POLBHTR1A
SCHEMBL8912344 0.82 POLB (0.52) LMNAMAPTMAPK1POLBHTR1A
SCHEMBL7291827 0.81 POLB (0.56) MITFLMNAMAPTMAPK1KMT2A
SCHEMBL30390986 0.79 L3MBTL1 (0.56) MAPTMAPK1POLBELANEL3MBTL1
SCHEMBL1163314 0.79 KDM1A (0.46) MAPTPOLBHTR1AKDM4EELANE
SCHEMBL9314504 0.78 CTSV (0.48) MITFLMNAMAPTMAPK1KMT2A
SCHEMBL38660362 0.78 TUBB4A (0.47) MAPTRHEB
SCHEMBL2085433 0.78 TUBB4A (0.47) MAPTRHEB

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-5354870-A Hair dyes L'OREAL (FR) 1994-10-11 US disclosed
US-5131911-A Hair dyes L'OREAL (FR) 1992-07-21 US disclosed