SCHEMBL10580436

SCHEMBL10580436

CCC(O)CCCCC1C=CCC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ CHRNB3 Q05901 1/20 0.32
▸ CHRNA6 Q15825 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
SCHEMBL10581245 0.89 USP2 (0.48) USP2ALDH1A1ALOX15TDP1CHRNB2
SCHEMBL10578217 0.81 USP2 (0.50) USP2ALDH1A1ALOX15TDP1CHRNB2
SCHEMBL10577863 0.76 USP2 (0.49) USP2ALDH1A1ALOX15TDP1
SCHEMBL5408963 0.76 ALDH1A1 (0.54) USP2ALDH1A1ALOX15TDP1CHRNB2
SCHEMBL9207936 0.74 ALDH1A1 (0.57) USP2ALDH1A1ALOX15TDP1
SCHEMBL16402730 0.74 ALDH1A1 (0.57) USP2ALDH1A1ALOX15TDP1
SCHEMBL9202780 0.74 ALDH1A1 (0.57) USP2ALDH1A1ALOX15TDP1
SCHEMBL9214287 0.74 ALDH1A1 (0.57) USP2ALDH1A1ALOX15TDP1
SCHEMBL9207373 0.74 ALDH1A1 (0.57) USP2ALDH1A1ALOX15TDP1
SCHEMBL167414 0.74 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4855322-A ANTIANDROGENS;SKIN DISORDERS CBD CORPORATION (US) 1989-08-08 — — US disclosed
US-4731458-A Spiro[bicyclo[3.2.0]heptane-6,2'-oxirane] derivatives CBD CORPORATION (US) 1988-03-15 — — US disclosed
US-4689349-A Anti-tumor halo bicyclo alkanones CBD CORPORATION (US) 1987-08-25 — — US disclosed
US-4689345-A ANTIANDROGENS CBD CORPORATION (US) 1987-08-25 — — US disclosed
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