SCHEMBL2749147

SCHEMBL2749147

Nc1ncc(-c2cnn(CCC(=O)N3CCCC3)c2)cc1-c1nc2ccccc2s1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MET P08581 12/20 0.46
SPR P35270 3/20 0.43
NPC1 O15118 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PDK2 Q15119 1/20 0.40
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.40
BTK Q06187 1/20 0.39

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
SCHEMBL2748538 0.99 MET (0.45) METSPRNPC1ALDH1A1HPGD
SCHEMBL2748607 0.93 MET (0.46) METNPC1ALDH1A1HPGDRAB9A
SCHEMBL2750001 0.92 MET (0.46) METSPRNPC1ALDH1A1HPGD
SCHEMBL2748653 0.91 BTK (0.47) METNPC1ALDH1A1HPGDRAB9A
SCHEMBL2749602 0.91 BTK (0.48) METNPC1ALDH1A1HPGDRAB9A
SCHEMBL2748664 0.89 MET (0.43) METSPRNPC1ALDH1A1HPGD
SCHEMBL2748423 0.88 MET (0.50) METNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL2748462 0.88 MET (0.50) METNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL2749608 0.84 MET (0.47) METNPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL2749337 0.84 BTK (0.47) METNPC1ALDH1A1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178668-B2 2-aminopyridine kinase inhibitors OSI Pharmaceuticals, LLC (US) 2012-05-15 US disclosed
EP-2265270-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2010-12-29 EP disclosed
WO-2009099982-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed
US-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. 2009-08-06 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-20090197862-A1 2-AMINOPYRIDINE KINASE INHIBITORS ERBB2, ABL2, TIE1 MET 38/4885SPR 3560/4885NPC1 3311/4885

“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.