SCHEMBL14014125

SCHEMBL14014125

Cc1cccc(NC(=O)Nc2cc(C(C)(C)C)on2)c1

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.76
MEN1 O00255 2/20 0.76
RAB9A P51151 2/20 0.76
NPC1 O15118 1/20 0.76
RAF1 P04049 4/20 0.71
ALDH1A1 P00352 1/20 0.71
FLT3 P36888 8/20 0.65
MAPK14 Q16539 4/20 0.64
CSF1R P07333 2/20 0.63
MAPK13 O15264 1/20 0.61
MAPK12 P53778 1/20 0.61
MAPK11 Q15759 1/20 0.61
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL18676609 0.89 ALDH1A1 (0.67) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL19916663 0.88 ALDH1A1 (0.65) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL1012716 0.87 RAB9A (0.76) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL2518089 0.86 MEN1 (1.00) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL13234449 0.86 KMT2A (0.74) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL13234452 0.86 MAPK14 (0.76) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL13234446 0.86 MAPK14 (0.74) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL1010628 0.86 KMT2A (0.74) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL19916582 0.85 RAB9A (0.54) KMT2AMEN1RAB9ANPC1RAF1
SCHEMBL13234435 0.85 MAPK14 (0.78) KMT2AMEN1RAB9ANPC1RAF1

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
EP-3147281-A1 QUINAZOLINE DERIVATIVES AS RAF KINASE MODULATORS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2017-03-29 EP disclosed
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 US disclosed
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 US disclosed
US-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 US disclosed
US-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 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-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR KMT2A 334/4885MEN1 1454/4885RAB9A 4166/4885

“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.