SCHEMBL7858287

SCHEMBL7858287

OC1CCCC(O)(c2ccccc2)C1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.43
OPRL1 P41146 4/20 0.43
TRPA1 O75762 1/20 0.41
OPRK1 P41145 2/20 0.41
OPRD1 P41143 1/20 0.41
ALDH1A1 P00352 1/20 0.38

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
Bromobenzene SCHEMBL8339717 0.91 OPRM1 (0.40) OPRM1OPRL1TRPA1OPRK1OPRD1
SCHEMBL8339722 0.88 OPRM1 (0.36) OPRM1OPRL1TRPA1OPRK1OPRD1
SCHEMBL5087603 0.82 OPRM1 (0.48) OPRM1OPRK1OPRD1
SCHEMBL11475738 0.80 TRPA1 (0.44) OPRM1OPRL1TRPA1OPRK1ALDH1A1
SCHEMBL28263872 0.80 POLB (0.38) ALDH1A1
SCHEMBL8470624 0.78 SRC (0.31) OPRM1OPRL1ALDH1A1
SCHEMBL2212456 0.78 SLC6A3 (0.45) OPRM1OPRL1TRPA1OPRK1OPRD1
SCHEMBL28266017 0.78 OPRM1 (0.37) OPRM1OPRK1OPRD1ALDH1A1
SCHEMBL5087604 0.77 ALDH1A1 (0.52) OPRM1OPRL1OPRK1OPRD1ALDH1A1
SCHEMBL11815569 0.76 OPRL1 (0.50) OPRM1OPRL1OPRK1OPRD1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6307085-B1 E.G., 3-METHOXY-3-(4-PHENYLPHENYL)BUT-1-YL BIS(4-PHENYLPHENYL)PHOSPHATE POLAROID CORPORATION 2001-10-23 US disclosed
US-6242154-B1 GENERATION OF ACID POLAROID CORPORATION 2001-06-05 US disclosed
US-6110638-A Process and composition for generation of acid POLAROID CORPORATION (US) 2000-08-29 US disclosed
US-6015907-A PHOTOSTABLE IMAGING DYES FOR ACID-MEDIATED MEDIA, ALSO FOR PHOTOSENSITIZING ONIUM SALTS TO VISIBLE BLUE RADIATION POLAROID CORPORATION (US) 2000-01-18 US disclosed
US-5914213-A MIXTURE; THERMAL DECOMPOSITION; IMAGE MEDIUM POLAROID CORPORATION (US) 1999-06-22 US disclosed