SCHEMBL9932075

SCHEMBL9932075

C[C@H]1CN(c2cc(-c3nc4ccccc4n3C)c(Cl)cn2)CCN1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PIM1 P11309 1/20 0.40
PIM3 Q86V86 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
PDE10A Q9Y233 2/20 0.39
LCK P06239 1/20 0.39
SRC P12931 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HDAC1 Q13547 1/20 0.38
ACVR1 Q04771 1/20 0.38
KHK P50053 1/20 0.37

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
SCHEMBL9933020 1.00 MEN1 (0.41) MEN1KMT2APIM1PIM3PIM2
SCHEMBL9971192 0.88 PIM2 (0.40) MEN1KMT2APIM1PIM3PIM2
SCHEMBL9971194 0.88 PIM2 (0.40) MEN1KMT2APIM1PIM3PIM2
SCHEMBL9932601 0.86 ADRB1 (0.44) MEN1KMT2APDE10AKDM4ENPC1
SCHEMBL9968325 0.86 MEN1 (0.42) MEN1KMT2APDE10ASMOHSD11B1
SCHEMBL9968326 0.86 MEN1 (0.42) MEN1KMT2APDE10ASMOHSD11B1
SCHEMBL9968363 0.85 MEN1 (0.45) MEN1KMT2APDE10AKDM4ENPC1
SCHEMBL12841434 0.83 MEN1 (0.44) MEN1KMT2APDE10AKDM4ENPC1
SCHEMBL9968324 0.83 MEN1 (0.44) MEN1KMT2AKDM4ESMO
SCHEMBL9932181 0.83 SMO (0.47) MEN1KMT2APDE10ASMO

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 MEN1 1168/4885KMT2A 310/4885PIM1 950/4885

“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.