SCHEMBL16098733

SCHEMBL16098733

COc1ccc(C)cc1N=C(c1ccccc1)c1cnccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
TBXA2R P21731 2/20 0.43
TBXAS1 P24557 2/20 0.43
KMT2A Q03164 6/20 0.41
MEN1 O00255 4/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HTT P42858 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
HSP90AA1 P07900 1/20 0.41
MAPK1 P28482 1/20 0.41
MMP14 P50281 1/20 0.41
ALDH1A1 P00352 3/20 0.40
POLB P06746 2/20 0.40
CYP1A2 P05177 1/20 0.39
MITF O75030 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL16097611 0.91 TBXA2R (0.46) KDM4ETBXA2RTBXAS1KMT2AMEN1
SCHEMBL16095522 0.88 TBXA2R (0.42) KDM4ETBXA2RTBXAS1KMT2AMEN1
SCHEMBL16097575 0.88 SMN1; SMN2 (0.50) KDM4EKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL17499362 0.87 TBXA2R (0.41) KDM4ETBXA2RTBXAS1KMT2AMEN1
SCHEMBL28040288 0.86 TBXA2R (0.40) KDM4ETBXA2RTBXAS1KMT2AMEN1
SCHEMBL16096298 0.86 TBXA2R (0.47) KDM4ETBXA2RTBXAS1KMT2AMEN1
SCHEMBL17499827 0.83 KDM4E (0.47) KDM4EKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL16095818 0.83 HTT (0.46) KDM4ETBXA2RKMT2AMEN1MAPT
SCHEMBL16097111 0.82 TBXA2R (0.45) TBXA2RTBXAS1KMT2AMEN1MAPT
SCHEMBL17499277 0.81 TBXA2R (0.43) TBXA2RTBXAS1KMT2AMEN1MAPT

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