SCHEMBL27273635

SCHEMBL27273635

c1ccc(-c2ccccc2N(c2cccc(-c3ccc4cc(-c5ccc6ccccc6c5)ccc4c3)c2)c2cccc3oc4ccccc4c23)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 2/20 0.34
▸ HSD17B2 P37059 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ ANO1 Q5XXA6 1/20 0.32
▸ PLA2G2A P14555 2/20 0.32
▸ PLA2G4A P47712 2/20 0.32
▸ PLA2G10 O15496 1/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ CYP1A1 P04798 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ FYN P06241 1/20 0.32
▸ MAPK3 P27361 1/20 0.32

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
SCHEMBL24919820 1.00 HSD17B1 (0.34) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL23225294 0.99 ANO1 (0.34) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL27273638 0.99 HSD17B1 (0.33) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL24471639 0.96 ANO1 (0.32) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL24472268 0.95 ANO1 (0.32) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL27272995 0.94 PLA2G2A (0.34) HSD17B1HSD17B2ALDH1A1MAPTANO1
SCHEMBL27272984 0.94 ANO1 (0.34) HSD17B1HSD17B2ALDH1A1MAPTANO1
SCHEMBL24964018 0.94 HSD17B1 (0.33) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL24472496 0.93 ANO1 (0.33) HSD17B1HSD17B2ALDH1A1MAPTCASP3
SCHEMBL27272988 0.93 ANO1 (0.33) HSD17B1HSD17B2ALDH1A1MAPTANO1

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-2024039095-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2024-02-22 — — WO disclosed
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