SCHEMBL9933119

SCHEMBL9933119

CC(=O)N1CCN(c2cc(-c3nc4ccccc4n3C)c(C)cn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMO Q99835 7/20 0.51
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NCF1 P14598 2/20 0.45
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
BRD4 O60885 2/20 0.44
MET P08581 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 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
SCHEMBL9932321 0.90 SMO (0.47) SMOMEN1KMT2ANCF1CKS1B
SCHEMBL9932427 0.90 SMO (0.59) SMOMEN1KMT2ANCF1CKS1B
SCHEMBL9931986 0.86 SMO (0.56) SMOMEN1KMT2AMET
SCHEMBL9932025 0.83 SMO (0.51) SMOSMN1; SMN2ALDH1A1KDM4ENPC1
SCHEMBL9932291 0.82 MEN1 (0.48) SMOMEN1KMT2ANCF1CKS1B
SCHEMBL1533906 0.81 KMT2A (0.46) SMOMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9933107 0.81 SMO (0.61) SMO
SCHEMBL9968527 0.81 SMO (0.49) SMOMEN1KMT2ABRD4ALDH1A1
SCHEMBL9968427 0.79 MEN1 (0.41) SMOMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL9968300 0.79 SMO (0.47) SMOMEN1KMT2A

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 SMO 1/4885MEN1 1168/4885KMT2A 310/4885

“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.