SCHEMBL9968482

SCHEMBL9968482

Cn1c(-c2ccnc(N3CCNCC3)c2)nc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
KARS1 Q15046 2/20 0.48
DYRK1A Q13627 1/20 0.48
ADRB1 P08588 1/20 0.47
NCF1 P14598 1/20 0.47
ATR Q13535 1/20 0.47
NMT1 P30419 6/20 0.46
PLD1 Q13393 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
ALOX15 P16050 1/20 0.45
RAB9A P51151 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HTR3A P46098 1/20 0.44
GRM2 Q14416 1/20 0.44

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
SCHEMBL9932398 0.97 KARS1 (0.52) MEN1KMT2AKARS1DYRK1AADRB1
SCHEMBL9932266 0.91 MEN1 (0.58) MEN1KMT2AKDM4ENPC1ALDH1A1
SCHEMBL9968330 0.88 MEN1 (0.55) MEN1KMT2ANMT1KDM4ENPC1
SCHEMBL9968309 0.88 MEN1 (0.55) MEN1KMT2ANMT1KDM4ENPC1
SCHEMBL9968316 0.85 MEN1 (0.51) MEN1KMT2AKARS1KDM4ENPC1
SCHEMBL9931742 0.84 MEN1 (0.50) MEN1KMT2AKARS1KDM4ENPC1
SCHEMBL9932466 0.84 MEN1 (0.50) MEN1KMT2AKDM4ENPC1ALDH1A1
SCHEMBL9932291 0.82 MEN1 (0.48) MEN1KMT2ANCF1GRM2
SCHEMBL9968327 0.82 MEN1 (0.48) MEN1KMT2AKDM4ENPC1ALDH1A1
SCHEMBL9932249 0.82 HSD11B1 (0.48) MEN1KMT2AKDM4ENPC1ALDH1A1

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 3 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
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 MEN1 1168/4885KMT2A 310/4885KARS1 1813/4885

“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.