SCHEMBL17268680

SCHEMBL17268680

COc1ccc2[nH]c(-c3cc(-c4ccc(CO)cc4OC)n[nH]3)nc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 4/20 0.47
ALPL P05186 1/20 0.43
MEN1 O00255 5/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 2/20 0.41
FOXO1 Q12778 4/20 0.41
AMY1A P0DUB6 1/20 0.40
PDPK1 O15530 1/20 0.39
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR3 P22607 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38

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
SCHEMBL17268727 0.90 CBFB (0.41) CBFBMEN1NPC1RAB9AKMT2A
SCHEMBL17255352 0.90 ALPL (0.50) ALPLMEN1NPC1RAB9AKMT2A
SCHEMBL17268683 0.89 AMY1A (0.49) CBFBMEN1NPC1RAB9AKMT2A
SCHEMBL17268674 0.89 FOXO1 (0.44) CBFBMEN1NPC1RAB9AKMT2A
SCHEMBL17268669 0.89 CBFB (0.43) CBFBMEN1NPC1RAB9AKMT2A
SCHEMBL17268660 0.88 FOXO1 (0.53) CBFBFOXO1AMY1AFGFR1FGFR2
SCHEMBL17268693 0.87 CBFB (0.39) CBFBKDM4EFOXO1AMY1A
SCHEMBL17268687 0.86 FOXO1 (0.45) CBFBMEN1NPC1RAB9AKMT2A
SCHEMBL17268678 0.85 RAB9A (0.49) CBFBMEN1NPC1RAB9AKMT2A
SCHEMBL17268703 0.85 TTR (0.44) CBFBMEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 CBFB 3736/4885ALPL 3575/4885MEN1 37/4885

“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.