SCHEMBL1381545

SCHEMBL1381545

N#Cc1ccc(COc2cccc(-n3cnc4cc(C(=O)NCc5cccnc5)ccc43)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
HTT P42858 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
RECQL P46063 1/20 0.52
SMPD1 P17405 2/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SCN9A Q15858 1/20 0.46
IDO1 P14902 1/20 0.46
TP53 P04637 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAPK1 P28482 2/20 0.45
GFER P55789 1/20 0.45
MAPK14 Q16539 1/20 0.44
ROCK2 O75116 1/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 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
SCHEMBL1379401 0.92 TSHR (0.50) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL1381717 0.91 LMNA (0.55) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL4506055 0.90 LMNA (0.54) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL1382294 0.90 LMNA (0.59) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL1378061 0.89 LMNA (0.56) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL4510328 0.89 LMNA (0.58) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL27030613 0.89 TP53 (0.55) LMNAMEN1KMT2ASCN9AIDO1
SCHEMBL2337537 0.88 GABRA1 (0.48) LMNAMEN1KMT2ASCN9AIDO1
SCHEMBL4500026 0.88 LMNA (0.56) LMNAHTTSMN1; SMN2RECQLMEN1
SCHEMBL1383844 0.88 LMNA (0.54) LMNAHTTSMN1; SMN2RECQLMEN1

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 8 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
EP-1664021-A1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-06-07 EP disclosed
WO-2005021531-A1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-03-10 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-20060189629-A1 N-substituted benzimidazolyl c-Kit inhibitors KIT, CHUK, TNNI3K LMNA 2408/4885HTT 4544/4885SMN1; SMN2 2900/4885

“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.