SCHEMBL5188166

SCHEMBL5188166

CNC(=O)CN(C)C(=O)N(C)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
KMT2A Q03164 3/20 0.49
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 2/20 0.46
RIPK1 Q13546 1/20 0.46
ABCC1 P33527 1/20 0.46
OPRM1 P35372 1/20 0.44
OPRL1 P41146 1/20 0.44

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
SCHEMBL3095761 0.84 NPC1 (0.70) NPC1RAB9ACA12CA9KMT2A
SCHEMBL13895390 0.81 MEN1 (0.57) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL3190680 0.81 MEP1B (0.53) NPC1RAB9ACA12CA9KMT2A
SCHEMBL13368580 0.78 NPC1 (0.49) NPC1RAB9ACA12CA9KMT2A
SCHEMBL968919 0.78 NPC1 (0.67) NPC1RAB9ACA12CA9KMT2A
SCHEMBL9547511 0.77 NPC1 (0.66) NPC1RAB9ACA12CA9KMT2A
SCHEMBL5188163 0.75 NPC1 (0.63) NPC1RAB9ACA12CA9KMT2A
SCHEMBL27577931 0.75 NPC1 (0.68) NPC1RAB9ACA12CA9KMT2A
SCHEMBL8426730 0.75 PRSS1 (0.56) NPC1RAB9AKMT2ATDP1ALDH1A1
SCHEMBL2565715 0.75 F2 (0.51) KMT2ATDP1MEN1ALDH1A1HPGD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279576-B2 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-10-09 US disclosed
EP-1590344-A4 ANTI-CANCER MEDICAMENTS DECIPHERA PHARMACEUTICALS LLC (US) 2007-08-29 EP disclosed
EP-1590344-A2 ANTI-CANCER MEDICAMENTS Deciphera Pharmaceuticals, Inc. (US) 2005-11-02 EP disclosed
US-20040176395-A1 Anti-cancer medicaments DECIPHERA PHARMACEUTICALS, LLC 2004-09-09 US disclosed
WO-2004060305-A2 ANTI-CANCER MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2004-07-22 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-20040176395-A1 Anti-cancer medicaments ABL1, ABL2, SRC NPC1 4548/4885RAB9A 2813/4885CA12 1796/4885

“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.