SCHEMBL13866537

SCHEMBL13866537

c1ccc(-c2nc3cc4nc(-c5ccccn5)[nH]c4cc3[nH]2)nc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.81
RAB9A P51151 5/20 0.81
PKM P14618 4/20 0.81
LMNA P02545 3/20 0.81
SMN1; SMN2 Q16637 3/20 0.81
KDM4E B2RXH2 2/20 0.81
MAPT P10636 2/20 0.81
KMT2A Q03164 1/20 0.81
CBFB Q13951 11/20 0.77
METAP2 P50579 9/20 0.77
METAP1 P53582 7/20 0.77
HPGD P15428 2/20 0.72
MTOR P42345 1/20 0.72
TP53 P04637 1/20 0.69
GAA P10253 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
RUNX1 Q01196 1/20 0.64
F2 P00734 1/20 0.61
F10 P00742 1/20 0.61

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
SCHEMBL13223456 0.90 NPC1 (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL30692551 0.87 CBFB (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL125187 0.87 CBFB (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL124228 0.87 CBFB (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL13866538 0.85 NPC1 (0.74) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL13866553 0.85 NPC1 (0.74) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL125153 0.84 CBFB (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL29484603 0.84 METAP2 (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL29484592 0.84 METAP2 (1.00) NPC1RAB9APKMLMNASMN1; SMN2
SCHEMBL124947 0.84 METAP2 (1.00) NPC1RAB9APKMLMNASMN1; 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-20090108733-A1 Precursors of Organometallic Compounds for Electroluminescent Materials GRACEL DISPLAY INC. (KR) 2009-04-30 US disclosed
US-20090108733-A1 Precursors of Organometallic Compounds for Electroluminescent Materials GRACEL DISPLAY INC. (KR) 2009-04-30 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-20090108733-A1 Precursors of Organometallic Compounds for Electroluminescent Materials ICMT, SOD1, NQO1 NPC1 3746/4885RAB9A 1764/4885PKM 867/4885

“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.