SCHEMBL20150033

SCHEMBL20150033

Clc1cccc(-c2nc(-c3ccccc3)nc(-c3cccc(Cl)c3)n2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I3 Q14994 1/20 0.57
DPP4 P27487 1/20 0.57
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
IDO1 P14902 1/20 0.52
PDE5A O76074 3/20 0.51
ABCG2 Q9UNQ0 2/20 0.51
ABCB1 P08183 1/20 0.51
ABCC1 P33527 1/20 0.51
HTT P42858 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ADORA2A P29274 2/20 0.50
ADORA1 P30542 2/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL30035200 1.00 NR1I3 (0.57) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL15477947 1.00 NR1I3 (0.57) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL30986825 0.98 NR1I3 (0.55) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL30986826 0.98 NR1I3 (0.55) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL31077790 0.96 NR1I3 (0.54) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL18921873 0.96 NR1I3 (0.54) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL21689650 0.96 NR1I3 (0.54) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL15741224 0.96 NR1I3 (0.54) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL17416282 0.96 NR1I3 (0.54) NR1I3DPP4NPC1RAB9ATP53
SCHEMBL19007139 0.96 NR1I3 (0.54) NR1I3DPP4NPC1RAB9ATP53

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
US-10964893-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-03-30 US disclosed
US-20180138419-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-05-17 US disclosed
US-20180138419-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2018-05-17 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 (2 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-20180138419-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, SLCO4C1 NR1I3 3393/4885DPP4 3502/4885NPC1 927/4885
US-10964893-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, SLCO4C1 NR1I3 3393/4885DPP4 3502/4885NPC1 927/4885

“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.