SCHEMBL8396356

SCHEMBL8396356

COc1ccc(CP(Cc2ccc(OC)cc2)(Cc2ccc(OC)cc2)(Cc2ccc(OC)cc2)OB(OCCCC(c2ccccc2)c2ccccc2)OCCCC(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASR P41180 2/20 0.46
KMT2A Q03164 7/20 0.43
MEN1 O00255 5/20 0.43
CNR1 P21554 3/20 0.43
CNR2 P34972 2/20 0.43
ATM Q13315 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 3/20 0.39
HTT P42858 3/20 0.39
MITF O75030 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
GPR55 Q9Y2T6 2/20 0.38
GPR35 Q9HC97 1/20 0.38

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
SCHEMBL8395177 0.92 TP53 (0.39) CASRKMT2AMEN1CNR1CNR2
SCHEMBL8396337 0.82 CYP1A2 (0.39) KMT2AMEN1ALDH1A1BACE1
SCHEMBL8397681 0.79 HRH1 (0.44) CNR1CNR2TDP1LMNA
SCHEMBL8398803 0.76 HRH1 (0.42) CASRKMT2AMEN1ALDH1A1LMNA
SCHEMBL8400044 0.76 HTR2A (0.41) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL8398399 0.73 HTR2A (0.39) KMT2AMEN1LMNANPSR1SMN1; SMN2
SCHEMBL8398554 0.72 CYP1A2 (0.39) ALDH1A1
SCHEMBL8397689 0.72 ALDH1A1 (0.40) KMT2AMEN1ATMALDH1A1TDP1
SCHEMBL8627163 0.72 HRH1 (0.41)
SCHEMBL8396343 0.70 CYP1A2 (0.37) TDP1

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-0613058-B1 Light-decolorizable recording material SHOWA DENKO KK (JP) 1999-06-02 EP disclosed
EP-0613058-A1 Light-decolorizable recording material SHOWA DENKO KABUSHIKI KAISHA (JP) 1994-08-31 EP disclosed