SCHEMBL2325993

SCHEMBL2325993

CC(Cl)Cc1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SLC6A2 P23975 2/20 0.45
SLC6A3 Q01959 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.44
TAAR1 Q96RJ0 3/20 0.40
LMNA P02545 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ADRB2 P07550 4/20 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
SCHEMBL45200 0.87 SLC6A2 (0.48) SLC6A2SLC6A3TAAR1MAOA
SCHEMBL22591638 0.80 GFER (0.50) GFERALDH1A1CYP3A4TSHRTDP1
SCHEMBL2406779 0.80 TSHR (0.50) GFERALDH1A1CYP3A4TSHRTDP1
SCHEMBL2326795 0.78 SLC6A2 (0.64) SLC6A2SLC6A3TAAR1LMNAADRB2
SCHEMBL158968 0.78 TAAR1 (0.64) SLC6A2SLC6A3TAAR1MAOA
SCHEMBL1718675 0.78 TAAR1 (0.64) SLC6A2SLC6A3TAAR1MAOA
SCHEMBL1718685 0.78 TAAR1 (0.64) SLC6A2SLC6A3TAAR1MAOA
Hydrochloric Acid SCHEMBL4922092 0.76 TAAR1 (0.61) SLC6A2SLC6A3TAAR1MAOA
SCHEMBL8085607 0.76 ALDH1A1 (0.46) GFERALDH1A1CYP3A4TSHRTDP1
SCHEMBL8429076 0.76 ALDH1A1 (0.46) GFERALDH1A1CYP3A4TSHRTDP1

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-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-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 (1 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 GFER 30/4885ALDH1A1 874/4885CYP3A4 319/4885

“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.