SCHEMBL16095802

SCHEMBL16095802

COc1ccccc1C(C)N=Cc1ncc(C)cn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
ACHE P22303 1/20 0.33
CA12 O43570 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
LPAR1 Q92633 4/20 0.33
P2RX3 P56373 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.32

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
SCHEMBL17499360 1.00 KDM4E (0.34) KDM4EMEN1KMT2ACA1CA2
SCHEMBL16095699 0.88
SCHEMBL17499314 0.88
SCHEMBL16099267 0.87 RAB9A (0.38) KDM4EMEN1KMT2ACA1CA2
SCHEMBL16099266 0.87 RAB9A (0.38) KDM4EMEN1KMT2ACA1CA2
SCHEMBL17499481 0.87
SCHEMBL16097180 0.84 HSD17B10 (0.35) KDM4EMEN1KMT2ACA1CA2
SCHEMBL16097176 0.84 HSD17B10 (0.35) KDM4EMEN1KMT2ACA1CA2
SCHEMBL16104943 0.83 KDM4E (0.38) KDM4EMEN1KMT2ALPAR1P2RX3
SCHEMBL16104942 0.83 KDM4E (0.38) KDM4EMEN1KMT2ALPAR1P2RX3

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