SCHEMBL11266342

SCHEMBL11266342

CC(C)c1ccc(NC(=O)NCc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.74
NPC1 O15118 6/20 0.65
RAB9A P51151 5/20 0.65
MAPT P10636 2/20 0.65
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
TP53 P04637 1/20 0.61
HPGD P15428 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
PTPN1 P18031 1/20 0.61
NAMPT P43490 2/20 0.61
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA9 Q16790 1/20 0.59
ROCK2 O75116 1/20 0.59
ROCK1 Q13464 1/20 0.59
ALDH1A1 P00352 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
POLB P06746 1/20 0.57

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
SCHEMBL16942610 0.87 NPC1 (0.79) EPHX1NPC1RAB9AMAPTKMT2A
SCHEMBL4898509 0.85 EPHX1 (1.00) EPHX1NPC1RAB9AMAPTKMT2A
SCHEMBL2831462 0.84 NPC1 (0.77) EPHX1NPC1RAB9AMAPTKMT2A
SCHEMBL23747600 0.83 RAB9A (0.61) EPHX1NPC1RAB9AMAPTKMT2A
SCHEMBL23747603 0.83 RAB9A (0.61) EPHX1NPC1RAB9AMAPTKMT2A
SCHEMBL5853157 0.83 NPC1 (0.88) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL3461361 0.83 CA2 (0.68) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL8177097 0.83 RAB9A (0.72) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL4117858 0.82 RAB9A (0.67) EPHX1NPC1RAB9AMAPTKMT2A
SCHEMBL5998344 0.82 MAOB (0.71) NPC1RAB9AMAPTKMT2AMEN1

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-9284318-B2 Protein kinase inhibitors PHARMASCIENCE, INC. (CA) 2016-03-15 US disclosed
US-9133186-B2 Hetero ring-fused imidazole derivative having AMPK activating effect SHIONOGI & CO., LTD. (JP) 2015-09-15 US disclosed
US-20150210696-A1 PROTEIN KINASE INHIBITORS GB005, INC. 2015-07-30 US disclosed
US-20130184240-A1 HETERO RING-FUSED IMIDAZOLE DERIVATIVE HAVING AMPK ACTIVATING EFFECT SHIONOGI & CO., LTD. (JP) 2013-07-18 US disclosed
EP-0051466-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-05-12 EP 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 (2 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-20150210696-A1 PROTEIN KINASE INHIBITORS PDGFRA, PDGFRB, KDR EPHX1 3239/4885NPC1 4450/4885RAB9A 1817/4885
US-20130184240-A1 HETERO RING-FUSED IMIDAZOLE DERIVATIVE HAVING AMPK ACTIVATING EFFECT PRKAA1, PRKAA2, PRKAG1 EPHX1 4685/4885NPC1 2194/4885RAB9A 1895/4885

“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.