SCHEMBL17417271

SCHEMBL17417271

CCc1cc2nc(C(=O)O)ccc2s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.46
RAB9A P51151 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
HSD17B10 Q99714 2/20 0.43
MAPK1 P28482 1/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MGAM O43451 1/20 0.41
HDAC6 Q9UBN7 2/20 0.39
PKM P14618 2/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
PPARA Q07869 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 2/20 0.38
DAO P14920 1/20 0.37
HPGD P15428 1/20 0.36
PRNP P04156 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL17417344 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2HSD17B10MEN1
SCHEMBL17448606 0.79 RAB9A (0.54) NPC1RAB9ASMN1; SMN2HSD17B10MGAM
SCHEMBL13201470 0.71 TBXAS1 (0.56) NPC1RAB9ASMN1; SMN2HSD17B10MAPK1
SCHEMBL17429962 0.70 NPC1 (0.34) NPC1RAB9ASMN1; SMN2HSD17B10MAPK1
SCHEMBL12523305 0.69 MGAM (0.53) NPC1RAB9ASMN1; SMN2MAPK1MEN1
SCHEMBL13201448 0.69 NPC1 (0.67) NPC1RAB9ASMN1; SMN2MAPK1MEN1
SCHEMBL9814904 0.67 MGAM (0.55) RAB9AHSD17B10KMT2AMGAML3MBTL1
SCHEMBL2175934 0.67 MGAM (0.64) RAB9ASMN1; SMN2HSD17B10MEN1KMT2A
SCHEMBL286929 0.66 MGAM (0.48) HSD17B10MEN1KMT2AMGAML3MBTL1
SCHEMBL31003152 0.66 NPC1 (0.46) NPC1RAB9ASMN1; SMN2HSD17B10RXFP1

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-9822124-B2 Bicyclic heteroaromatic carboxamide compounds useful as Pim kinase inhibitors INCYTE CORPORATION (US) 2017-11-21 US disclosed
US-9822124-B2 Bicyclic heteroaromatic carboxamide compounds useful as Pim kinase inhibitors INCYTE CORPORATION (US) 2017-11-21 US disclosed
WO-2016010897-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2016-01-21 WO disclosed
WO-2016010897-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2016-01-21 WO disclosed
US-20160009726-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION 2016-01-14 US disclosed
US-20160009726-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION 2016-01-14 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-20160009726-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS PIM1, PIM2, PIM3 NPC1 3148/4885RAB9A 3960/4885SMN1; SMN2 4446/4885

“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.