SCHEMBL9932899

SCHEMBL9932899

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

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PDE10A Q9Y233 13/20 0.43
SMO Q99835 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL9931884 1.00 MEN1 (0.44) MEN1KMT2APDE10ASMOSMN1; SMN2
SCHEMBL9968386 0.94 PDE10A (0.43) MEN1KMT2APDE10ASMO
SCHEMBL9968385 0.94 PDE10A (0.43) MEN1KMT2APDE10ASMO
SCHEMBL9932029 0.93 MEN1 (0.44) MEN1KMT2APDE10ASMOSMN1; SMN2
SCHEMBL9931954 0.93 SMO (0.42) MEN1KMT2APDE10ASMO
SCHEMBL9932900 0.93 SMO (0.42) MEN1KMT2APDE10ASMO
SCHEMBL9968363 0.90 MEN1 (0.45) MEN1KMT2APDE10ASMN1; SMN2KDM4E
SCHEMBL9968336 0.89 SMO (0.43) MEN1KMT2APDE10ASMO
SCHEMBL9968365 0.89 SMO (0.43) MEN1KMT2APDE10ASMO
SCHEMBL9968412 0.89 MEN1 (0.47) MEN1KMT2APDE10ASMOSMN1; 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 4 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
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 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.