SCHEMBL28040971

SCHEMBL28040971

O[C@@H]1CC(c2ccccc2)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.48
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44
HTR2B P41595 2/20 0.44
HRH3 Q9Y5N1 2/20 0.44

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
SCHEMBL13906155 1.00 SIGMAR1 (0.48) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL5709410 1.00 SIGMAR1 (0.48) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL13051102 1.00 SIGMAR1 (0.48) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL1388099 0.85 SIGMAR1 (0.55) SIGMAR1HTR2AHTR2CHTR2BHRH3
SCHEMBL8694573 0.83 IGF1R (0.42)
SCHEMBL15251760 0.82 DRD2 (0.48) HTR2AHTR2CHTR2BHRH3
SCHEMBL13084081 0.82 DRD2 (0.48) HTR2AHTR2CHTR2BHRH3
SCHEMBL2070340 0.82 DRD2 (0.48) HTR2AHTR2CHTR2BHRH3
SCHEMBL2069258 0.82 DRD2 (0.48) HTR2AHTR2CHTR2BHRH3
SCHEMBL3803961 0.82 DRD2 (0.48) HTR2AHTR2CHTR2BHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105087670-A Method for preparing (R)-phenyl-indanol through candida UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN claimed
CN-105087667-A Method for preparing (R)-3-phenyl-indanol through tarlaromyces flavus UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN claimed
CN-105087670-A Method for preparing (R)-phenyl-indanol through candida UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN disclosed
CN-105087670-A Method for preparing (R)-phenyl-indanol through candida UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN disclosed
CN-105087667-A Method for preparing (R)-3-phenyl-indanol through tarlaromyces flavus UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN disclosed
CN-105087667-A Method for preparing (R)-3-phenyl-indanol through tarlaromyces flavus UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN disclosed
CN-105087667-A Method for preparing (R)-3-phenyl-indanol through tarlaromyces flavus UNIV QINGDAO SCIENCE & TECHNOLOGY 2015-11-25 CN disclosed