SCHEMBL1379900

SCHEMBL1379900

CN(C)CCCNC(=O)c1ccc2c(c1)ncn2-c1cccc(OCCOc2ccc(F)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.57
HPGD P15428 4/20 0.56
MAPK1 P28482 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
FGFR1 P11362 3/20 0.54
SRC P12931 3/20 0.54
MEN1 O00255 5/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.47

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
SCHEMBL1381221 0.95 HPGD (0.56) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1381505 0.93 KMT2A (0.61) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1377663 0.89 HPGD (0.69) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1381992 0.88 HPGD (0.59) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1378082 0.87 KMT2A (0.60) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1381939 0.84 KMT2A (0.54) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1377140 0.83 KMT2A (0.67) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1378088 0.83 HPGD (0.53) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL1379909 0.82 HPGD (0.61) KMT2AHPGDMAPK1CYP1A2CYP2C9
SCHEMBL4505163 0.82 KMT2A (0.67) KMT2AHPGDMAPK1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4769720-B2 2011-09-07 JP claimed
US-20060189629-A1 N-substituted benzimidazolyl c-Kit inhibitors OSI PHARMACEUTICALS, INC. 2006-08-24 US claimed
EP-1664021-A1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-06-07 EP claimed
WO-2005021531-A1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-03-10 WO claimed
US-7521448-B2 N-substituted benzimidazolyl c-Kit inhibitors OSI PHARMACEUTICALS, INC. (US) 2009-04-21 US disclosed
US-20060189629-A1 N-substituted benzimidazolyl c-Kit inhibitors OSI PHARMACEUTICALS, INC. 2006-08-24 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-20060189629-A1 N-substituted benzimidazolyl c-Kit inhibitors KIT, CHUK, TNNI3K KMT2A 518/4885HPGD 1154/4885MAPK1 340/4885

“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.