SCHEMBL2117463

SCHEMBL2117463

Cc1csc(-c2nc(Cl)c(Cl)c(Cl)n2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2B6 P20813 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NOS1 P29475 1/20 0.39
ADORA2A P29274 9/20 0.38
ADORA1 P30542 6/20 0.38
TGFBR1 P36897 3/20 0.38
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL21143865 0.88 ADORA2A (0.41) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL21143788 0.85 PDE10A (0.39) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL21143840 0.82 PDE10A (0.37) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL21143714 0.80 PDE10A (0.36) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL19686894 0.80 PDE10A (0.41) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL21166156 0.79 PDE10A (0.35) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL21143668 0.77 LMNA (0.49) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL2116011 0.76 IDH1 (0.33)
SCHEMBL21144367 0.75 PDE10A (0.43) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9
SCHEMBL18157874 0.75 SMN1; SMN2 (0.55) PDE10ACYP3A4CYP2E1CYP2A6CYP2C9

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
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-8158787-B2 Process for producing trichloropyrimidine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-17 US disclosed
US-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2128141-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND Sumitomo Chemical Company, Limited (JP) 2009-12-02 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 (4 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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PDE10A 484/4885CYP3A4 1136/4885CYP2E1 1707/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 PDE10A 484/4885CYP3A4 1136/4885CYP2E1 1707/4885
US-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND DPYD, TYMP, TST PDE10A 2769/4885CYP3A4 1172/4885CYP2E1 350/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PDE10A 484/4885CYP3A4 1136/4885CYP2E1 1707/4885

“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.