SCHEMBL17255334

SCHEMBL17255334

COc1cc(-c2cc(-c3nc4cc(C(F)(F)F)c(Br)cc4[nH]3)[nH]n2)cc(OC)c1OC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 8/20 0.42
CHEK2 O96017 2/20 0.36
APP P05067 1/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
POLB P06746 2/20 0.36
RUNX1 Q01196 1/20 0.36
TSHR P16473 1/20 0.36
GUSB P08236 1/20 0.35
ACHE P22303 1/20 0.34

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
SCHEMBL17255189 0.89 GUSB (0.45) AMY1AAPPKDM4EMAPTMEN1
SCHEMBL17255263 0.88 AMY1A (0.37) AMY1AKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL17268716 0.85 AMY1A (0.37) AMY1AAPPMAPTMEN1KMT2A
SCHEMBL17255216 0.85 RAB9A (0.49) AMY1AKDM4EMAPTMEN1ALDH1A1
SCHEMBL17255252 0.82 SMN1; SMN2 (0.41) AMY1AAPPKDM4EMAPTMEN1
SCHEMBL17255338 0.82 AMY1A (0.43) AMY1ACHEK2KDM4EMAPTMEN1
SCHEMBL17255149 0.81 NPBWR1 (0.46) KDM4EMAPTMEN1ALDH1A1KMT2A
SCHEMBL17268713 0.81 CBFB (0.37) AMY1A
SCHEMBL17255232 0.81 RAB9A (0.43) KDM4EMAPTMEN1ALDH1A1GAA
SCHEMBL17255355 0.80 TRPV1 (0.43) KDM4EMAPTMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2944635-A1 PYRAZOLE LINKED BENZIMIDAZOLE CONJUGATES AND A PROCESS FOR PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2015-11-18 EP claimed
US-9951049-B2 Pyrazole linked benzimidazole conjugates and a process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2018-04-24 US disclosed
US-20150329527-A1 PYRAZOLE LINKED BENZIMIDAZOLE CONJUGATES AND A PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-11-19 US disclosed
US-20150329527-A1 PYRAZOLE LINKED BENZIMIDAZOLE CONJUGATES AND A PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-11-19 US disclosed
EP-2944635-A1 PYRAZOLE LINKED BENZIMIDAZOLE CONJUGATES AND A PROCESS FOR PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2015-11-18 EP 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-20150329527-A1 PYRAZOLE LINKED BENZIMIDAZOLE CONJUGATES AND A PROCESS FOR PREPARATION THEREOF BRDT, MCL1, MGST3 AMY1A 4542/4885CHEK2 754/4885APP 4489/4885

“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.