SCHEMBL9932759

SCHEMBL9932759

Cn1c(-c2cc(CNCCCO)ncc2Cl)nc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
PDE2A O00408 3/20 0.39
CYP2C9 P11712 1/20 0.39
KDR P35968 2/20 0.39
PTK2 Q05397 2/20 0.39
PLK1 P53350 1/20 0.39
AURKB Q96GD4 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
PDE10A Q9Y233 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36

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
SCHEMBL9932761 0.79 MEN1 (0.43) KMT2AMEN1TP53PDE2ACYP2C9
SCHEMBL9931758 0.79 MKNK1 (0.48) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL9968510 0.77 MEN1 (0.44) KMT2AMEN1TP53PDE2ACYP2C9
SCHEMBL1533963 0.75 MEN1 (0.62) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL9968291 0.73 KMT2A (0.45) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL20867533 0.73 MEN1 (0.52) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL29978921 0.73 MEN1 (0.52) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL28341352 0.73 MEN1 (0.52) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL9932095 0.72 CCNT1 (0.45) KMT2AMEN1TP53CYP2C9KDR
SCHEMBL9968293 0.72 MEN1 (0.44) KMT2AMEN1TP53PDE2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 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-20120157471-A1 BENZIMIDAZOLE DERIVATIVES SMO, RB1, GLI1 KMT2A 310/4885MEN1 1168/4885TP53 323/4885

“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.