SCHEMBL19320615

SCHEMBL19320615

Cc1nn2cc(-c3cc(-c4ccc(Cl)cc4)no3)nc2s1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.72
RAB9A P51151 7/20 0.72
TP53 P04637 5/20 0.72
MAPT P10636 5/20 0.72
SMN1; SMN2 Q16637 4/20 0.72
NFKB1 P19838 2/20 0.72
NFKB2 Q00653 2/20 0.72
RELA Q04206 2/20 0.72
KDM4E B2RXH2 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ALOX15 P16050 1/20 0.54
F2RL3 Q96RI0 9/20 0.52
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL19320617 0.85 F2RL3 (0.76) F2RL3
SCHEMBL18678469 0.76 F2RL3 (0.73) NPC1RAB9ATP53MAPTSMN1; SMN2
SCHEMBL13186820 0.72 TP53 (0.74) NPC1RAB9ATP53MAPTSMN1; SMN2
SCHEMBL23657842 0.72 SMN1; SMN2 (1.00) NPC1RAB9ATP53MAPTSMN1; SMN2
SCHEMBL10878341 0.71 TP53 (1.00) NPC1RAB9ATP53MAPTSMN1; SMN2
SCHEMBL5309504 0.71 SMN1; SMN2 (0.72) NPC1RAB9ATP53MAPTSMN1; SMN2
SCHEMBL16708205 0.71 F2RL3 (0.80) F2RL3
SCHEMBL18489825 0.70 NPC1 (0.86) NPC1RAB9AMAPT
SCHEMBL16707966 0.70 F2RL3 (0.74) F2RL3
SCHEMBL16708157 0.70 F2RL3 (0.77) NPC1RAB9ATP53MAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9963466-B2 Substituted 5-membered heterocyclic analogs as protease activated receptor 4 (PAR-4) antagonists VANDERBILT UNIVERSITY (US) 2018-05-08 US disclosed
US-20170253617-A1 Substituted 5-Membered Heterocyclic Analogs as Protease Activated Receptor 4 (PAR-4) Antagonists VANDERBILT UNIVERSITY 2017-09-07 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-20170253617-A1 Substituted 5-Membered Heterocyclic Analogs as Protease Activated Receptor 4 (PAR-4) Antagonists F2RL3, F2R, F2RL1 NPC1 2109/4885RAB9A 2218/4885TP53 1679/4885

“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.