SCHEMBL1521947

SCHEMBL1521947

CNc1cc2c(cn1)CN(c1ccc(F)c(NC(=O)NC3CCCCC3)c1)C(=O)N2C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
KMT2A Q03164 3/20 0.41
EPHX2 P34913 4/20 0.40
POLB P06746 1/20 0.40
PARP1 P09874 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.35
HTT P42858 1/20 0.35
GAA P10253 1/20 0.35
TNK2 Q07912 1/20 0.35
MAP4K2 Q12851 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL29894322 0.90 NPC1 (0.40) RAB9ANPC1KMT2AEPHX2POLB
SCHEMBL1521769 0.90 NPC1 (0.40) RAB9ANPC1KMT2AEPHX2POLB
SCHEMBL1521987 0.90 FGFR1 (0.43) RAB9ANPC1KMT2AEPHX2POLB
SCHEMBL1522057 0.90 NPC1 (0.39) RAB9ANPC1KMT2AEPHX2POLB
SCHEMBL1521676 0.87 PARP1 (0.38) RAB9ANPC1KMT2AEPHX2POLB
SCHEMBL1521797 0.82 TNK2 (0.37) RAB9ANPC1POLBTNK2MAP4K2
SCHEMBL1521794 0.80 MAPK14 (0.44)
SCHEMBL1521380 0.79 KDR (0.36)
SCHEMBL1521917 0.79 KDR (0.40) TNK2MAP4K2
SCHEMBL1521767 0.79 BRAF (0.53) ALDH1A1CYP2C9CYP2C19

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
US-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases FLYNN DANIEL L 2011-05-19 US claimed
US-7897762-B2 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2011-03-01 US claimed
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2009-04-16 US claimed
US-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases FLYNN DANIEL L 2011-05-19 US disclosed
US-7897762-B2 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2011-03-01 US disclosed
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2009-04-16 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 (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-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases BRAF, PRKDC, RAF1 RAB9A 1244/4885NPC1 4287/4885KMT2A 1762/4885
US-20090099190-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 RAB9A 1244/4885NPC1 4287/4885KMT2A 1762/4885

“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.