SCHEMBL10948249

SCHEMBL10948249

COc1c(C)cc(C2=C(OC(=O)C(C)(C)C)CC(C)(C)CC2=O)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 1/20 0.33
▸ HSD17B2 P37059 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
SCHEMBL10947368 0.80 MEN1 (0.35) —
SCHEMBL10949107 0.76 KMT2A (0.39) —
SCHEMBL10947384 0.74 ELANE (0.38) —
SCHEMBL10947522 0.68 PGR (0.42) —
SCHEMBL13710178 0.66 HRH3 (0.41) —
SCHEMBL10943778 0.66 TSHR (0.39) —
SCHEMBL10944971 0.65 HPGD (0.38) —
SCHEMBL10947059 0.64 ALDH1A1 (0.35) —
SCHEMBL10946923 0.63 KMT2A (0.46) —
SCHEMBL13817806 0.63 HTT (0.33) —

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
US-4526723-A Microbiocides UNION CARBIDE CORPORATION (US) 1985-07-02 — — US disclosed
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