SCHEMBL2332837

SCHEMBL2332837

C[Bi](C)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.50
IDO1 P14902 4/20 0.48
MAOB P27338 3/20 0.44
ALDH1A1 P00352 3/20 0.43
PYCR1 P32322 1/20 0.43
KDM4E B2RXH2 1/20 0.42
KIF11 P52732 2/20 0.41
KMT2A Q03164 1/20 0.41
MIF P14174 1/20 0.41
TSHR P16473 1/20 0.40
DAO P14920 1/20 0.40
SRD5A2 P31213 1/20 0.39

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
SCHEMBL2328783 0.76 IDO1 (0.48) TAAR1IDO1TSHRDAO
SCHEMBL91061 0.75 TAAR1 (0.54) TAAR1IDO1MAOBALDH1A1PYCR1
SCHEMBL1575802 0.75 TAAR1 (0.54) TAAR1IDO1MAOBALDH1A1KDM4E
SCHEMBL676931 0.75 TAAR1 (0.54) TAAR1IDO1MAOBALDH1A1KDM4E
SCHEMBL2096666 0.74 SRD5A2 (0.59) TAAR1IDO1MAOBALDH1A1KDM4E
SCHEMBL934227 0.74 TAAR1 (0.73) TAAR1IDO1MAOBALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL266277 0.73 TAAR1 (0.52) TAAR1IDO1MAOBALDH1A1PYCR1
SCHEMBL27918003 0.73 TAAR1 (0.52) TAAR1IDO1MAOBALDH1A1KDM4E
SCHEMBL63468 0.72 ALDH1A1 (0.67) TAAR1IDO1ALDH1A1KIF11TSHR
SCHEMBL28701927 0.72 TAAR1 (0.56) TAAR1IDO1MAOBALDH1A1PYCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2133357-B1 LIVING RADICAL POLYMERIZATION PROMOTER OTSUKA CHEMICAL CO LTD (JP) 2016-11-16 EP disclosed
US-8076430-B2 Living radical polymerization promoter OTSUKA CHEMICAL CO., LTD. (JP) 2011-12-13 US disclosed
EP-1829883-B1 ORGANIC BISMUTH COMPOUND, METHOD FOR PRODUCING SAME, LIVING RADICAL POLYMERIZATION INITIATOR, METHOD FOR PRODUCING POLYMER USING SAME, AND POLYMER OTSUKA CHEMICAL CO LTD (JP) 2011-08-17 EP disclosed
US-7847043-B2 Organic bismuth compound, method for producing same, living radical polymerization initiator, method for producing polymer using same, and polymer OTSUKA CHEMICAL CO., LTD. (JP) 2010-12-07 US disclosed
US-20100022728-A1 LIVING RADICAL POLYMERIZATION PROMOTER OTSUKA CHEMICAL CO., LTD. (JP) 2010-01-28 US disclosed
EP-2133357-A1 LIVING RADICAL POLYMERIZATION PROMOTER Otsuka Chemical Holdings Co., Ltd. (JP) 2009-12-16 EP disclosed
US-20070265404-A1 Organic Bismuth Compound, Method for Producing Same, Living Radical Polymerization Initiator, Method for Producing Polymer Using Same, and Polymer OTSUKA CHEMICAL CO., LTD. (JP) 2007-11-15 US disclosed
EP-1829883-A1 ORGANIC BISMUTH COMPOUND, METHOD FOR PRODUCING SAME, LIVING RADICAL POLYMERIZATION INITIATOR, METHOD FOR PRODUCING POLYMER USING SAME, AND POLYMER Otsuka Chemical Co., Ltd. (JP) 2007-09-05 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070265404-A1 Organic Bismuth Compound, Method for Producing Same, Living Radical Polymerization Initiator, Method for Producing Polymer Using Same, and Polymer DOHH, COASY, ODC1 TAAR1 1638/4885IDO1 1078/4885MAOB 507/4885
US-20100022728-A1 LIVING RADICAL POLYMERIZATION PROMOTER DNMT1, CYP1B1, DNMT3B TAAR1 1106/4885IDO1 2931/4885MAOB 880/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.