SCHEMBL11664076

SCHEMBL11664076

[CH]=CC(OC)C(C)(C)Oc1ccc(F)cc1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.37
▸ NQO2 P16083 1/20 0.31
▸ CASR P41180 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
SCHEMBL11663924 0.83 CA4 (0.35) —
SCHEMBL11518124 0.78 CASR (0.36) NFE2L2CASR
SCHEMBL11663075 0.73 CASR (0.35) CASR
SCHEMBL11661985 0.73 L3MBTL1 (0.37) —
SCHEMBL24225606 0.72 ALDH1A1 (0.37) NFE2L2CASR
SCHEMBL11661775 0.72 RELA (0.35) NFE2L2CASR
SCHEMBL11665566 0.71 NFE2L2 (0.34) NFE2L2CASR
SCHEMBL11659218 0.69 TAAR1 (0.33) CASR
SCHEMBL4977051 0.67 NFE2L2 (0.41) NFE2L2CASR
SCHEMBL11517918 0.67 NFE2L2 (0.36) NFE2L2NQO2CASR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4099014-A BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1978-07-04 — — US disclosed
US-4033989-A 9-Deoxy-PGF2 Analogs THE UPJOHN COMPANY (US) 1977-07-05 — — US disclosed
US-4016184-A PROSTAGLANDINS, BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1977-04-05 — — US disclosed
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