SCHEMBL4744155

SCHEMBL4744155

CC(Cl)(C#N)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
CYP2D6 P10635 2/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
OPRM1 P35372 1/20 0.41
DRD3 P35462 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 2/20 0.39
ATM Q13315 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP1A2 P05177 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ALOX15 P16050 1/20 0.38
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
KCNN4 O15554 3/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL6789126 0.82 LTA4H (0.44) TSHRMAPK1ALDH1A1MAPTKMT2A
SCHEMBL7030622 0.77 MAPK1 (0.46) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL15259639 0.76 TSHR (0.46) TSHRMAPK1CYP3A4ALDH1A1CYP1A2
SCHEMBL5875525 0.75 MAPK1 (0.44) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL1021158 0.75 GRM1 (0.49) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL11143559 0.75 TSHR (0.50) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL5152927 0.75 TSHR (0.50) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL230672 0.75 MAPK1 (0.44) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL20629458 0.73 CYP2D6 (0.42) TSHRCYP2D6DRD2DRD4OPRM1
SCHEMBL11637695 0.72 TSHR (0.52) TSHRMAPK1CYP3A4ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746178-B2 Polymer production method and radical polymerization initiating group-containing compound DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2023-09-05 US disclosed
US-11746178-B2 Polymer production method and radical polymerization initiating group-containing compound DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2023-09-05 US disclosed
US-10982033-B2 Polymer production method and radical polymerization initiating group-containing compound DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2021-04-20 US disclosed
EP-3424960-A1 POLYMER PRODUCTION METHOD AND RADICAL POLYMERIZATION INITIATING GROUP-CONTAINING COMPOUND Dainichiseika Color & Chemicals Mfg. Co., Ltd. (JP) 2019-01-09 EP disclosed
US-20190002619-A1 POLYMER PRODUCTION METHOD AND RADICAL POLYMERIZATION INITIATING GROUP-CONTAINING COMPOUND DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2019-01-03 US disclosed
CN-100445375-C Modified nitrilases and their use in methods for the production of carboxylic acids BASF AG (DE) 2008-12-24 CN disclosed
WO-2008117148-A1 SUBSTITUTED OXADIAZOLE ANALOGS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-10-02 WO disclosed
CN-1753990-A Modified nitrilases and their use in methods for the production of carboxylic acids BASF AG (DE) 2006-03-29 CN disclosed
US-6713629-B2 PLANT FUNGICIDE NIPPON SODA CO., LTD. (JP) 2004-03-30 US disclosed
US-20030114649-A1 5,5-Disubstituted thiazolidine derivative pesticides NIPPON SODA CO., LTD. 2003-06-19 US disclosed
US-6476055-B1 5,5-disubstituted thiazolidine derivative pesticides NIPPON SODA CO. LTD. (JP) 2002-11-05 US disclosed
WO-2000037432-A1 METHOD OF PRODUCING AROMATIC HALOGEN METHYL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2000-06-29 WO disclosed
EP-0518412-B1 Process for the alpha-chlorination of phenylacetonitriles DSM NV (NL) 1998-02-25 EP disclosed
US-5274165-A Process for the α-chlorination of phenylacetonitriles DSM N.V. (NL) 1993-12-28 US disclosed
EP-0518412-A1 Process for the alpha-chlorination of phenylacetonitriles DSM N.V. (NL) 1992-12-16 EP disclosed
EP-0140229-B1 PROCESS FOR PRODUCING A HALOGEN-CONTAINING ETHYLBENZENE DERIVATIVE Tosoh Corporation (JP) 1988-08-17 EP disclosed
EP-0137494-B1 PROCESS FOR PRODUCING AN ALPHA-HALOGENO-BETA-PHENYLPROPIONIC ACID Tosoh Corporation (JP) 1988-01-27 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-20030114649-A1 5,5-Disubstituted thiazolidine derivative pesticides NAT1, DDT, TH TSHR 28/4885CYP2D6 88/4885DRD2 157/4885

“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.