SCHEMBL16103244

SCHEMBL16103244

COc1cc(C)ccc1/N=C/c1nc2ccccc2n1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 7/20 0.50
POLB P06746 2/20 0.50
TP53 P04637 2/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
GAA P10253 2/20 0.47
MAPT P10636 5/20 0.46
LMNA P02545 3/20 0.46
HPGD P15428 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 5/20 0.46
NPC1 O15118 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
PKM P14618 2/20 0.46
CDK5 Q00535 1/20 0.46
PAX8 Q06710 1/20 0.46

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
SCHEMBL16103246 1.00 KDM4E (0.50) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16102669 0.90 ALDH1A1 (0.53) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16102667 0.90 ALDH1A1 (0.53) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16102637 0.89 KDM4E (0.49) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16102634 0.89 KDM4E (0.49) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL28039991 0.86 KDM4E (0.46) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL814116 0.86 KDM4E (0.56) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16101976 0.86 KDM4E (0.56) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16103529 0.83 KDM4E (0.48) KDM4EALDH1A1POLBTP53ALOX15
SCHEMBL16103526 0.83 KDM4E (0.48) KDM4EALDH1A1POLBTP53ALOX15

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 EP disclosed
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO disclosed