SCHEMBL7676239

SCHEMBL7676239

CCCSc1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.56
PKM P14618 3/20 0.54
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 5/20 0.44
GAA P10253 4/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
MAPK1 P28482 1/20 0.43
POLB P06746 1/20 0.43
USP2 O75604 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL16592104 0.92 NPSR1 (0.55) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL7901272 0.90 NPSR1 (0.53) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL22809569 0.86 PKM (0.52) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL22809528 0.84 PKM (0.57) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL14234223 0.81 PKM (0.51) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL29958095 0.79 NPSR1 (0.40) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL6970770 0.78 PKM (0.50) NPSR1PKMSMN1; SMN2KMT2AKDM4E
SCHEMBL14234225 0.76 PKM (0.53) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL7821174 0.76 PKM (0.65) NPSR1PKMLMNASMN1; SMN2KMT2A
SCHEMBL2655252 0.76 PLAU (0.37) NPSR1PKMLMNAKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10023532-B2 Alkyl phenyl sulfide derivative and pest control agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2018-07-17 US disclosed
US-6407245-B2 HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-06-18 US disclosed
US-20010012897-A1 Substituted thiopyridines HAMPRECHT GERHARD (DE) 2001-08-09 US disclosed
US-6262273-B1 REACTING A3-CHLORO-2-HALOPYRIDINE WITH THIO COMPOUND IN PRESENCE OF TRIFLUOROACETIC ACID OR PERCHLORIC ACID TO GIVE PYRIDINE THIOETHER COMPOUND WHICH IS OXIDIZED TO GIVE THIOPYRIDINE COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2001-07-17 US disclosed
US-6191280-B1 REACTING SUBSTITUTED 2-HALOPYRIDINE DERIVATIVE WITH A THIO COMPOUND IN PRESENCE OF COPPER CATALYST TO GIVE A PYRIDINE THIOETHER, AND THEN OXIDIZING THE THIOETHER INTERMEDIATE TO FORM SULFOXIDE OR SULFONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0984935-A1 METHOD FOR PRODUCING SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP disclosed
EP-0934275-A1 SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1999-08-11 EP disclosed
WO-1998054139-A1 METHOD FOR PRODUCING SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1998-12-03 WO disclosed
WO-1998011072-A1 SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1998-03-19 WO 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-20010012897-A1 Substituted thiopyridines CBR1, CLIC1, CBR3 NPSR1 1793/4885PKM 4340/4885LMNA 1928/4885
US-10023532-B2 Alkyl phenyl sulfide derivative and pest control agent C1S, TRPA1, STK39 NPSR1 245/4885PKM 1047/4885LMNA 4259/4885

“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.