SCHEMBL9968458

SCHEMBL9968458

CN(CC(C)(C)O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
CYP2C9 P11712 2/20 0.40
KDM4E B2RXH2 6/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 3/20 0.39
HTT P42858 3/20 0.39
HSD17B10 Q99714 3/20 0.39
LMNA P02545 3/20 0.39
HPGD P15428 2/20 0.39
TP53 P04637 1/20 0.39
PKM P14618 1/20 0.39
GFER P55789 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
ERAP1 Q9NZ08 2/20 0.39
GAA P10253 3/20 0.39
KDR P35968 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
SCHEMBL9932761 0.85 MEN1 (0.43) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9968510 0.85 MEN1 (0.44) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9968296 0.84 MEN1 (0.45) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9968292 0.83 MEN1 (0.43) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9932202 0.83 MEN1 (0.44) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9968512 0.82 MEN1 (0.42) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9968293 0.82 MEN1 (0.44) KMT2AMEN1KDM4ESMN1; SMN2MAPT
SCHEMBL9932409 0.79 MEN1 (0.41) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL9971209 0.77 MEN1 (0.39) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2
SCHEMBL1533963 0.76 MEN1 (0.62) KMT2AMEN1CYP2C9KDM4ESMN1; SMN2

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 3 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
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 KMT2A 310/4885MEN1 1168/4885CYP2C9 3632/4885

“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.