SCHEMBL29668407

SCHEMBL29668407

N#Cc1ccc(Cn2c(Cl)nc3ccncc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.47
DRD2 P14416 1/20 0.46
TBXA2R P21731 1/20 0.46
CYP19A1 P11511 6/20 0.44
CYP11B1 P15538 7/20 0.44
CYP11B2 P19099 7/20 0.44
ALOX5AP P20292 1/20 0.41
KCNH2 Q12809 1/20 0.40
TP53 P04637 1/20 0.39
AR P10275 1/20 0.39
LMNA P02545 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 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
SCHEMBL22465117 1.00 NLRP3 (0.47) NLRP3DRD2TBXA2RCYP19A1CYP11B1
SCHEMBL22465523 0.89 S1PR1 (0.46) NLRP3DRD2TBXA2RCYP19A1CYP11B1
SCHEMBL29668403 0.89 S1PR1 (0.46) NLRP3DRD2TBXA2RCYP19A1CYP11B1
SCHEMBL4092820 0.82 DRD2 (0.64) DRD2TBXA2RALOX5APKCNH2TP53
SCHEMBL22481419 0.82 CYP11B2 (0.50) DRD2TBXA2RCYP19A1CYP11B1CYP11B2
SCHEMBL29668281 0.82 CYP11B2 (0.50) DRD2TBXA2RCYP19A1CYP11B1CYP11B2
SCHEMBL20919761 0.80 DRD2 (0.52) DRD2TBXA2RCYP19A1CYP11B2ALOX5AP
SCHEMBL8094795 0.79 AGTR1 (0.48) NLRP3
SCHEMBL22465561 0.77 DRD2 (0.45) DRD2TBXA2RCYP19A1CYP11B1CYP11B2
SCHEMBL22465204 0.77 TBXA2R (0.52) DRD2TBXA2RCYP19A1ALOX5AP

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-11332459-B2 Benzimidazole derivatives and their uses TEIJIN PHARMA LIMITED (JP) 2022-05-17 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-11332459-B2 Benzimidazole derivatives and their uses TRPC6, TRPV6, TRPM6 NLRP3 955/4885DRD2 2913/4885TBXA2R 349/4885

“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.