SCHEMBL24747829

SCHEMBL24747829

c1ccc(-c2ccccc2N(c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)c2cc(-c3cc4ccccc4c4ccccc34)ccc2-c2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.33
CYP11B1 P15538 1/20 0.32
ALOX5 P09917 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MPI P34949 1/20 0.31
KMT2A Q03164 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL24751284 0.95 PIM3 (0.35) PIM3CYP11B1ALOX5KDM4EMEN1
SCHEMBL24747827 0.95 PIM3 (0.35) PIM3CYP11B1ALOX5KDM4EMEN1
SCHEMBL24749131 0.95 PIM3 (0.35) PIM3CYP11B1ALOX5KDM4EMEN1
SCHEMBL24749465 0.92 PIM3 (0.31) PIM3
SCHEMBL24749467 0.92 ALOX5 (0.35) PIM3ALOX5
SCHEMBL24749016 0.92 CA12 (0.36) PIM3CYP11B1ALOX5KDM4EMEN1
SCHEMBL24749436 0.92 CA12 (0.36) PIM3CYP11B1ALOX5KDM4EMEN1
SCHEMBL24749432 0.92 CA12 (0.36) PIM3CYP11B1ALOX5KDM4EMEN1
SCHEMBL24749434 0.92 PIM3 (0.33) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24749435 0.91 CA12 (0.35) PIM3CYP11B1ALOX5KDM4EMEN1

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
WO-2022259886-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE 出光興産株式会社 2022-12-15 WO disclosed