SCHEMBL31184151

SCHEMBL31184151

c1ccc2nc(N3CCCC3)cnc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.72
RAB9A P51151 6/20 0.72
MAPT P10636 6/20 0.72
ALDH1A1 P00352 4/20 0.72
SMN1; SMN2 Q16637 3/20 0.72
GAA P10253 3/20 0.72
NFKB1 P19838 2/20 0.72
NFKB2 Q00653 2/20 0.72
RELA Q04206 2/20 0.72
HTR3A P46098 1/20 0.72
HRH4 Q9H3N8 1/20 0.72
HPGD P15428 1/20 0.72
HTT P42858 1/20 0.72
KDM4E B2RXH2 4/20 0.64
NPSR1 Q6W5P4 2/20 0.64
LMNA P02545 1/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
TSHR P16473 1/20 0.57
MAPK1 P28482 1/20 0.57

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
SCHEMBL29832295 1.00 NPC1 (0.72) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL3552442 0.98 NPC1 (0.70) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL1713999 0.87 NPC1 (0.70) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL6350588 0.85 CHRNB2 (0.62) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5910889 0.84 NPC1 (0.57) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL24830044 0.84 NPC1 (0.71) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL606857 0.84 HRH4 (1.00) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL2114532 0.84 NPC1 (0.66) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL31184229 0.84 NPC1 (0.71) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL29832726 0.84 NPC1 (0.71) NPC1RAB9AMAPTALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709714-A1 SUBSTITUTED QUINOXALINES Mirati Therapeutics, Inc. (US) 2026-03-18 EP disclosed
US-20240391882-A1 Substituted Quinoxalines Mirati Therapeutics, Inc. 2024-11-28 US disclosed
WO-2024238221-A1 SUBSTITUTED QUINOXALINES Mirati Therapeutics, Inc. (US) 2024-11-21 WO 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-20240391882-A1 Substituted Quinoxalines NQO2, NQO1, NDUFV3 NPC1 2158/4885RAB9A 249/4885MAPT 3938/4885

“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.