SCHEMBL8386198

SCHEMBL8386198

CC1(OC(=O)CBr)CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.50
▸ TRPA1 O75762 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP2C19 P33261 2/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL5987940 0.98 CYP19A1 (0.47) CYP19A1TRPA1ALDH1A1CYP2C19L3MBTL1
SCHEMBL25397835 0.83 CYP19A1 (0.53) CYP19A1CYP2C19
SCHEMBL31628707 0.82 CYP19A1 (0.45) CYP19A1ALDH1A1
SCHEMBL9912807 0.81 CYP19A1 (0.51) CYP19A1ALDH1A1CYP2C19
SCHEMBL5702555 0.81 CYP19A1 (0.51) CYP19A1CYP2C19
SCHEMBL5702559 0.81 CYP19A1 (0.56) CYP19A1CYP2C19
SCHEMBL119668 0.81 CYP19A1 (0.51) CYP19A1ALDH1A1CYP2C19
SCHEMBL14982571 0.79 CYP19A1 (0.50) CYP19A1CYP2C19
SCHEMBL2065251 0.79 CYP19A1 (0.50) CYP19A1ALDH1A1CYP2C19
SCHEMBL1447086 0.79 CYP19A1 (0.50) CYP19A1CYP2C19

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
EP-0709736-B1 Method for producing compounds used in a positive chemically amplified resist composition FUJI PHOTO FILM CO LTD (JP) 1999-04-21 — — EP disclosed
US-5693452-A FOR USE IN PRODUCTION OF SEMICONDUCTORS FUJI PHOTO FILM CO., LTD. (JP) 1997-12-02 — — US disclosed
EP-0709736-A1 Positive chemically amplified resist composition and method for producing compounds used therein FUJI PHOTO FILM CO., LTD. (JP) 1996-05-01 — — EP disclosed
US-5374656-A Nervous system disorders, gastrointestinal disorders RHONE-POULENC RORER, S.A. (FR) 1994-12-20 — — US disclosed
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