SCHEMBL5423234

SCHEMBL5423234

Cc1cccc(CCNc2nc(C)nc3sc(C)cc23)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.46
▸ GALR3 O60755 1/20 0.46
▸ NR2F2 P24468 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ LMNA P02545 3/20 0.40
▸ HTT P42858 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ FGFR1 P11362 1/20 0.39
▸ APP P05067 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ KCNK2 O95069 1/20 0.38
▸ TAAR1 Q96RJ0 1/20 0.37
▸ CSNK2A2 P19784 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
SCHEMBL5426412 0.89 ALDH1A1 (0.50) NPC1GALR3NR2F2RAB9AKDM4E
SCHEMBL5436019 0.88 FGFR1 (0.45) NPC1GALR3NR2F2RAB9AKDM4E
SCHEMBL5429571 0.88 TAAR1 (0.45) NPC1GALR3NR2F2RAB9AKDM4E
SCHEMBL5433132 0.88 LMNA (0.45) NPC1GALR3NR2F2RAB9AKDM4E
SCHEMBL5425019 0.86 RAB9A (0.50) NPC1GALR3NR2F2RAB9ALMNA
SCHEMBL5427207 0.86 GALR3 (0.48) NPC1GALR3NR2F2RAB9ANPSR1
SCHEMBL5435709 0.85 NPC1 (0.42) NPC1GALR3NR2F2RAB9ANPSR1
SCHEMBL5430227 0.83 GBA1 (0.47) NPC1GALR3NR2F2RAB9AKDM4E
SCHEMBL5429124 0.82 KDM4E (0.49) NPC1GALR3NR2F2RAB9ANPSR1
SCHEMBL20667984 0.81 ALDH1A1 (0.46) CYP1A2CYP2C19KDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275984-A1 Novel Thieno-Pyridine and Thieno-Pyrimidine Derivatives and Their Use as Positive Allosteric Modulators of Mglur2-Receptors JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-29 — — US 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-20070275984-A1 Novel Thieno-Pyridine and Thieno-Pyrimidine Derivatives and Their Use as Positive Allosteric Modulators of Mglur2-Receptors GRM2, GRIA2, GRM1 NPC1 3777/4885GALR3 305/4885NR2F2 739/4885

“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.

Send feedback