SCHEMBL29324428

SCHEMBL29324428

C=c1ccccc(=C)c(-c2ccc3ccccc3c2)c2ccccc2c1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 6/20 0.44
▸ ESR2 Q92731 6/20 0.44
▸ HSD17B1 P14061 1/20 0.42
▸ HSD17B2 P37059 1/20 0.42
▸ CYP1A1 P04798 1/20 0.41
▸ CYP1B1 Q16678 1/20 0.41
▸ CYP1A2 P05177 2/20 0.40
▸ GSTP1 P09211 1/20 0.40
▸ GPR84 Q9NQS5 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CYP17A1 P05093 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40

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
SCHEMBL1013297 0.89 ESR1 (0.52) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL29341909 0.87 CYP1A2 (0.42) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL30730877 0.87 ESR1 (0.53) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL5502280 0.87 ESR1 (0.53) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL27872147 0.85 ESR1 (0.53) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL15366606 0.85 ESR1 (0.53) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL15366682 0.85 HSD17B1 (0.52) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL27889956 0.85 ESR1 (0.52) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL31355617 0.85 ESR1 (0.55) ESR1ESR2HSD17B1HSD17B2CYP1A1
SCHEMBL24174187 0.84 HSD17B1 (0.52) ESR1ESR2HSD17B1HSD17B2CYP1A1

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
US-20240244971-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2024-07-18 — — US disclosed
US-20240244970-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2024-07-18 — — US disclosed
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