SCHEMBL9968291

SCHEMBL9968291

CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
TP53 P04637 1/20 0.42
GAA P10253 2/20 0.41
HPGD P15428 1/20 0.41
GRM5 P41594 2/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
LCK P06239 1/20 0.40
NPC1 O15118 4/20 0.40
MAPK1 P28482 1/20 0.40
HCRTR1 O43613 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
HTT P42858 1/20 0.40
CASP7 P55210 1/20 0.40
HBB P68871 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL9931758 0.90 MKNK1 (0.48) KMT2AMEN1TP53GAAKDM4E
SCHEMBL9932095 0.90 CCNT1 (0.45) KMT2AMEN1TP53GAAKDM4E
SCHEMBL9931924 0.86 MEN1 (0.41) KMT2AMEN1TP53GAAHPGD
SCHEMBL9933111 0.85 CA1 (0.42) KMT2AMEN1TP53GAAHPGD
SCHEMBL1533963 0.79 MEN1 (0.62) KMT2AMEN1TP53GAAHPGD
SCHEMBL9968296 0.77 MEN1 (0.45) KMT2AMEN1TP53GAAHPGD
SCHEMBL29978921 0.77 MEN1 (0.52) KMT2AMEN1TP53GAAHPGD
SCHEMBL20867533 0.77 MEN1 (0.52) KMT2AMEN1TP53GAAHPGD
SCHEMBL28341352 0.77 MEN1 (0.52) KMT2AMEN1TP53GAAHPGD
SCHEMBL9968293 0.76 MEN1 (0.44) KMT2AMEN1TP53GAAHPGD

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.