SCHEMBL24655401

SCHEMBL24655401

c1ccc(-c2cccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc(-c4cc5ccc6ccccc6c5c5ccccc45)c3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
GPR84 Q9NQS5 1/20 0.36
ESR1 P03372 3/20 0.36
ESR2 Q92731 3/20 0.36
GSTP1 P09211 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ACMSD Q8TDX5 2/20 0.33
MCL1 Q07820 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
CA12 O43570 1/20 0.33
CYP17A1 P05093 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP11B1 P15538 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
SCHEMBL24657604 0.97 KDM4E (0.38) HSD17B1HSD17B2GPR84ESR1ESR2
SCHEMBL24656398 0.97 KDM4E (0.38) HSD17B1HSD17B2GPR84ESR1ESR2
SCHEMBL24657658 0.97 KDM4E (0.38) HSD17B1HSD17B2GPR84ESR1ESR2
SCHEMBL24657609 0.97 KDM4E (0.35) HSD17B1HSD17B2GPR84ESR1ESR2
SCHEMBL24657484 0.96 KDM4E (0.37) HSD17B1HSD17B2GPR84KDM4EMEN1
SCHEMBL24656397 0.95 KDM4E (0.38) HSD17B1HSD17B2GPR84ESR1ESR2
SCHEMBL24655764 0.95 KDM4E (0.36) GPR84KDM4EMEN1KMT2AACMSD
SCHEMBL24657353 0.94 KDM4E (0.40) HSD17B1HSD17B2GPR84KDM4EMEN1
SCHEMBL24656409 0.94 KDM4E (0.40) HSD17B1HSD17B2GPR84KDM4EMEN1
SCHEMBL24657392 0.94 KDM4E (0.40) HSD17B1HSD17B2GPR84KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4243100-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 EP disclosed
WO-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 WO disclosed