SCHEMBL463189

SCHEMBL463189

CC(=O)N1CCN(c2ccc(C(=O)NC3=CC=CC(F)(NC(=O)c4cccc(Cl)c4)C3)c(-c3ccccc3)n2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CKS1B P61024 2/20 0.39
SKP1 P63208 2/20 0.39
SKP2 Q13309 2/20 0.39
MAPT P10636 4/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 3/20 0.35
TP53 P04637 2/20 0.34
ADORA1 P30542 3/20 0.34
ADORA2A P29274 1/20 0.34
FAAH O00519 1/20 0.34
WDR5 P61964 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL462167 0.77 NPC1 (0.54) KMT2ANPC1RAB9AL3MBTL1CKS1B
SCHEMBL403228 0.65 NPC1 (0.58) KMT2ANPC1RAB9AL3MBTL1MAPT
SCHEMBL462057 0.63 KMT2A (0.46) KMT2ANPC1RAB9AL3MBTL1MAPT
SCHEMBL462058 0.61 NPC1 (0.53) KMT2ANPC1RAB9AL3MBTL1MAPT
SCHEMBL462059 0.61 NPC1 (0.53) KMT2ANPC1RAB9AL3MBTL1MAPT
SCHEMBL4970783 0.60 KMT2A (0.47) KMT2ANPC1RAB9AL3MBTL1MAPT
SCHEMBL403314 0.59 SMO (0.71) KMT2ANPC1RAB9AL3MBTL1MAPT
SCHEMBL21193436 0.57 HTR3E (0.64) KMT2AL3MBTL1CKS1BSKP1SKP2
SCHEMBL30803989 0.57 HTR3E (0.64) KMT2AL3MBTL1CKS1BSKP1SKP2
SCHEMBL13453343 0.57 HTR1A (0.71) KMT2ANPC1RAB9AL3MBTL1MAPT

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
EP-1957461-B1 BISAMIDE INHIBITORS OF HEDGEHOG SIGNALING GENENTECH INC (US) 2016-11-02 EP disclosed
US-8101610-B2 Blocking signals; anticancer agents GENENTECH, INC. (US) 2012-01-24 US disclosed
US-20080269215-A1 Bisamide Inhibitors of Hedgehog Signaling GENENTECH INC. (US) 2008-10-30 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-20080269215-A1 Bisamide Inhibitors of Hedgehog Signaling SHH, GLI1, SMO KMT2A 507/4885NPC1 2248/4885RAB9A 240/4885

“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.