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SCHEMBL19986080

SCHEMBL19986080

c1ccc2c(c1)oc1c2c2c3ccccc3c3ccccc3c2c2c3ccccc3n(-c3cccc4sc5ccccc5c34)c12

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRDT Q58F21 1/20 0.32
▸ ESR2 Q92731 2/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ GPR3 P46089 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
SCHEMBL19986078 0.87 MAOA (0.33) —
SCHEMBL19986073 0.87 ESR2 (0.36) BRDTESR2ESR1GPR3
SCHEMBL19986086 0.83 BRDT (0.34) BRDT
SCHEMBL19986065 0.83 MEN1 (0.36) —
SCHEMBL19985910 0.83 ESR2 (0.32) ESR2ESR1
SCHEMBL17246019 0.83 ESR2 (0.33) BRDTESR2ESR1GPR3
SCHEMBL24514785 0.82 GPR3 (0.33) BRDTGPR3
SCHEMBL19986022 0.82 CNR1 (0.37) —
SCHEMBL19986097 0.82 BRDT (0.35) BRDT
SCHEMBL19986072 0.81 KDM4E (0.41) —

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 — — US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 — — US disclosed