SCHEMBL9932634

SCHEMBL9932634

Cn1c(-c2cc(N3C[C@@H](CO)[C@@](C)(CO)C3)ncc2Cl)nc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PDE10A Q9Y233 4/20 0.36
KDM4E B2RXH2 2/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
SMO Q99835 10/20 0.34
CYP2C9 P11712 1/20 0.34
KDR P35968 1/20 0.34
PLK1 P53350 1/20 0.34
PTK2 Q05397 1/20 0.34
AURKB Q96GD4 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9968502 1.00 MEN1 (0.38) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL9968364 0.94 MEN1 (0.37) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL9971226 0.85 MEN1 (0.41) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL9932630 0.85 MEN1 (0.41) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL12841524 0.84 MEN1 (0.42) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL9932115 0.84 MEN1 (0.42) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL12841435 0.81 MEN1 (0.40) MEN1KMT2APDE10AKDM4EMAPT
SCHEMBL9932557 0.80 SMO (0.43) MEN1KMT2APDE10ASMO
SCHEMBL9968345 0.80 MEN1 (0.39) MEN1KMT2APDE10AKDM4EGAA
SCHEMBL9931884 0.80 MEN1 (0.44) MEN1KMT2APDE10AKDM4ESMO

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 MEN1 1168/4885KMT2A 310/4885PDE10A 1879/4885

“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.