SCHEMBL27653124

SCHEMBL27653124

OCCn1c2ccccc2c2ccc(-c3ccccc3O)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.47
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
BCL2L1 Q07817 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FABP4 P15090 3/20 0.40
FABP5 Q01469 3/20 0.40
FABP3 P05413 1/20 0.40
ESR2 Q92731 1/20 0.40
KDM4E B2RXH2 2/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39

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
SCHEMBL27653144 0.88 KDM4E (0.47) METAP2MAPTPOLBATMMEN1
SCHEMBL27653121 0.82 POLB (0.48) MAPTPOLBATMMEN1KMT2A
SCHEMBL27653081 0.80 WEE1 (0.42) MAPTPOLBATMMEN1KMT2A
SCHEMBL27673089 0.80 MAPT (0.46) MAPTPOLBATMMEN1KMT2A
SCHEMBL27673132 0.80 MAPT (0.46) MAPTPOLBATMMEN1KMT2A
SCHEMBL27673125 0.79 RXRA (0.52) METAP2MAPTPOLBATMMEN1
SCHEMBL27673101 0.79 MAPT (0.40) MAPTPOLBATMMEN1KMT2A
SCHEMBL3875130 0.79 POLB (0.52) MAPTPOLBATMMEN1KMT2A
SCHEMBL3875840 0.79 POLB (0.56) MAPTPOLBATMMEN1KMT2A
SCHEMBL149177 0.78 MEN1 (0.63) MAPTPOLBATMMEN1KMT2A

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
CN-1937994-A Keratin dyeing compounds, keratin dyeing compositions containing them and their use PROCTER & GAMBLE (US) 2007-03-28 CN disclosed