SCHEMBL17417344

SCHEMBL17417344

CCCc1cc2nc(C(=O)O)ccc2s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
PIM2 Q9P1W9 1/20 0.43
KDM4E B2RXH2 3/20 0.40
PKM P14618 3/20 0.40
NFKB1 P19838 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
THPO P40225 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40

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
SCHEMBL17417271 0.88 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4EPKM
SCHEMBL17448606 0.76 RAB9A (0.54) NPC1RAB9ASMN1; SMN2PIM2KDM4E
SCHEMBL17429956 0.71 PIM2 (0.33) NPC1RAB9ASMN1; SMN2PIM2KDM4E
SCHEMBL17417405 0.71 PIM2 (0.44) NPC1RAB9ASMN1; SMN2PIM2KDM4E
SCHEMBL30744751 0.66 KDM4E (0.59) RAB9AKDM4EALDH1A1MAPTALOX15
SCHEMBL13791178 0.65 DYRK1A (0.49) MEN1KMT2ACYP3A4MAPTALOX15
SCHEMBL2175934 0.65 MGAM (0.64) RAB9ASMN1; SMN2KDM4EL3MBTL1MEN1
SCHEMBL286929 0.64 MGAM (0.48) KDM4EL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL10080449 0.64 ALDH1A1 (0.52) KDM4EPKMNFKB1L3MBTL1MEN1
SCHEMBL8185281 0.64 HSD17B10 (0.68) NPC1RAB9ASMN1; SMN2PKMNFKB1

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
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
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.