SCHEMBL9933111

SCHEMBL9933111

Cn1c(-c2cc(NCCS(N)(=O)=O)ncc2Cl)nc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 3/20 0.39
GAA P10253 2/20 0.39
ATM Q13315 2/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HCRTR1 O43613 1/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
HTT P42858 1/20 0.39
CASP7 P55210 1/20 0.39
HBB P68871 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL9931924 0.91 MEN1 (0.41) CA1CA2MEN1KMT2AKDM4E
SCHEMBL9932095 0.86 CCNT1 (0.45) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL9968291 0.85 KMT2A (0.45) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL9931758 0.84 MKNK1 (0.48) MEN1KMT2AKDM4EMAPTGAA
SCHEMBL1533963 0.74 MEN1 (0.62) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL9932409 0.73 MEN1 (0.41) CA1CA2MEN1KMT2AKDM4E
SCHEMBL9971209 0.73 MEN1 (0.39) CA1CA2MEN1KMT2AKDM4E
SCHEMBL9932026 0.72 SMO (0.60)
SCHEMBL20867533 0.72 MEN1 (0.52) MEN1KMT2AKDM4ENPC1RAB9A
SCHEMBL29978921 0.72 MEN1 (0.52) MEN1KMT2AKDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
WO-2011027249-A2 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2011-03-10 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 (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-20120157471-A1 BENZIMIDAZOLE DERIVATIVES SMO, RB1, GLI1 CA1 3161/4885CA2 1358/4885MEN1 1168/4885

“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.