SCHEMBL23764223

SCHEMBL23764223

CC1(C)C=CC=C(N(c2ccccc2)c2ccc(-c3cccnc3)cc2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.37
MKNK1 Q9BUB5 3/20 0.36
MKNK2 Q9HBH9 3/20 0.36
CYP19A1 P11511 3/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
CYP2A6 P11509 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KMT2A Q03164 1/20 0.34
CYP11B2 P19099 3/20 0.34
CYP11B1 P15538 3/20 0.34
CYP17A1 P05093 1/20 0.34
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL23764224 0.91 KMO (0.39) MKNK1MKNK2CYP19A1CYP3A4CYP2A6
SCHEMBL23764229 0.88 MAPT (0.38) MAPTKMT2AKDM4ESMN1; SMN2
SCHEMBL23764210 0.85 CYP11B1 (0.35) KIF11MKNK1MKNK2CYP2A6CYP11B2
SCHEMBL23764221 0.81 NOTUM (0.36) KIF11MKNK1CYP17A1
SCHEMBL23764419 0.80 KCNA5 (0.33)
SCHEMBL23764233 0.80 CYP1A2 (0.37) CYP19A1CYP2D6CYP2C9CYP2C19CYP2A6
SCHEMBL23764414 0.79
SCHEMBL23764230 0.76 ACVR1 (0.37) CYP1A2
SCHEMBL2262911 0.76 CYP2A6 (0.58) KIF11MKNK1MKNK2CYP19A1CYP3A4
SCHEMBL16484496 0.76 CYP2A6 (0.58) KIF11MKNK1MKNK2CYP19A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2907803-B1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT TORAY INDUSTRIES (JP) 2021-08-18 EP disclosed