SCHEMBL23764233

SCHEMBL23764233

CC1(C)C=CC=C(N(c2ccccc2)c2ccc(-c3ccccn3)cc2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP19A1 P11511 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
CYP11B1 P15538 1/20 0.32
KDM4E B2RXH2 2/20 0.31
LMNA P02545 2/20 0.31
DHODH Q02127 1/20 0.31
POLB P06746 1/20 0.31
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CCR8 P51685 1/20 0.31
METAP1 P53582 1/20 0.31
BLM P54132 1/20 0.31
HIF1A Q16665 1/20 0.31
DOHH Q9BU89 1/20 0.31
P4HTM Q9NXG6 1/20 0.31

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
SCHEMBL23764237 0.90 TGFBR1 (0.34) ABL1BCRKDM4ELMNAKDM6B
SCHEMBL23764229 0.84 MAPT (0.38) KDM4EMAPTKMT2A
SCHEMBL23764235 0.80 NPC1 (0.41) CYP1A2CYP2D6CYP2C9CYP2C19KDM4E
SCHEMBL23764223 0.80 KIF11 (0.37) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL23764230 0.79 ACVR1 (0.37) CYP1A2AURKA
SCHEMBL23764418 0.78 ALDH1A1 (0.37) CYP1A2CYP2D6CYP2C19POLBNPC1
SCHEMBL23764419 0.76 KCNA5 (0.33)
SCHEMBL23764409 0.75 CYP2D6 (0.31) CYP2D6CYP2C19HIF1A
SCHEMBL21012595 0.75 KDM4E (0.50) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19
SCHEMBL6356563 0.75 KDM4E (0.50) CYP1A2CYP2D6CYP19A1CYP2C9CYP2C19

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