SCHEMBL10601957

SCHEMBL10601957

CC1CC(=O)c2cc(F)ccc2C1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.62
▸ PARP1 P09874 1/20 0.41
▸ PARP10 Q53GL7 1/20 0.41
▸ STAT3 P40763 1/20 0.40
▸ MAOB P27338 10/20 0.40
▸ NOS3 P29474 1/20 0.40
▸ SRD5A1 P18405 3/20 0.36

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
SCHEMBL30346069 1.00 ACHE (0.62) ACHEPARP1PARP10STAT3MAOB
SCHEMBL15153883 0.86 ACHE (0.49) ACHESTAT3MAOBNOS3SRD5A1
SCHEMBL12433394 0.80 ACHE (0.61) ACHEPARP1PARP10STAT3MAOB
SCHEMBL24897684 0.79 ACHE (0.53) ACHEPARP1PARP10NOS3SRD5A1
SCHEMBL30917890 0.79 PBRM1 (0.53) ACHEPARP1PARP10STAT3SRD5A1
SCHEMBL24897762 0.79 GRM5 (0.45) ACHEPARP1PARP10STAT3SRD5A1
SCHEMBL1699469 0.79 PBRM1 (0.53) ACHEPARP1PARP10STAT3SRD5A1
SCHEMBL13534180 0.77 ACHE (0.48) ACHESRD5A1
SCHEMBL8254380 0.77 STAT3 (0.42) ACHESTAT3
SCHEMBL2585275 0.76 ACHE (1.00) ACHEPARP1PARP10NOS3SRD5A1

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
EP-0115133-B1 SPIRO-3-HETERO-AZOLONES FOR TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1989-01-25 — — EP disclosed
US-4556670-A Spiro-3-hetero-azolones for treatment of diabetic complications PFIZER INC. (US) 1985-12-03 — — US disclosed
EP-0115133-A1 Spiro-3-hetero-azolones for treatment of diabetic complications PFIZER INC. (US) 1984-08-08 — — EP disclosed
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