SCHEMBL24749434

SCHEMBL24749434

c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c4cc(-c5cc6ccccc6c6ccccc56)ccc4-c4ccccc4)cc3)cc2-c2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.33
CYP11B1 P15538 1/20 0.32
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
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30

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
SCHEMBL24751249 0.97 CYP11B1 (0.31) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24749131 0.97 PIM3 (0.35) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24751284 0.97 PIM3 (0.35) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24747827 0.97 PIM3 (0.35) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24749433 0.93 GPR84 (0.33) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24747824 0.93 F9 (0.33) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24750035 0.93 PIM3 (0.33) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24749979 0.93 HSD17B1 (0.32) CYP11B1KDM4EMEN1ALDH1A1MAPT
SCHEMBL24748092 0.93 CYP11B1 (0.33) PIM3CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24999251 0.93 PIM3 (0.35) PIM3CYP11B1KDM4EMEN1ALDH1A1

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