SCHEMBL16615368

SCHEMBL16615368

CC(C)(C)c1ccc(N(c2ccc(-c3cccc(-c4ccccn4)c3)cc2)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.47
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KIF11 P52732 3/20 0.41
DHODH Q02127 1/20 0.40
METAP2 P50579 1/20 0.40
HIF1A Q16665 1/20 0.38
ASIC1 P78348 1/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 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
SCHEMBL15868785 0.92 TRPV1 (0.43) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL2480086 0.92 TRPV1 (0.53) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL11927621 0.90 TRPV1 (0.52) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL20023653 0.90 TRPV1 (0.48) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL28432843 0.86 GRM5 (0.43) ABL1BCRALDH1A1POLBMAPT
SCHEMBL15082326 0.85 GRM5 (0.48) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL25878105 0.81 KIF11 (0.57) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL12524042 0.81 TRPV1 (0.64) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL16203118 0.80 TRPV1 (0.42) TRPV1ABL1BCRALDH1A1POLB
SCHEMBL14065136 0.80 ABL1 (0.48) ABL1BCRMAPTHIF1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10403823-B2 Polymer and organic light emitting device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2019-09-03 US disclosed
US-20160218291-A1 POLYMER AND ORGANIC LIGHT EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2016-07-28 US disclosed
US-20160218291-A1 POLYMER AND ORGANIC LIGHT EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2016-07-28 US disclosed
WO-2015044656-A1 POLYMER AND ORGANIC LIGHT EMITTING DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-04-02 WO disclosed