SCHEMBL6748149

SCHEMBL6748149

c1cnc2ccc(Nc3ccc(-c4ccc(Nc5ccc6ncccc6c5)cc4)cc3)cc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.63
RAB9A P51151 4/20 0.63
POLB P06746 3/20 0.63
MAPT P10636 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
GRM4 Q14833 1/20 0.55
ABCB1 P08183 1/20 0.55
ABCC1 P33527 1/20 0.55
ABCG2 Q9UNQ0 1/20 0.55
EGFR P00533 2/20 0.54
DYRK1A Q13627 1/20 0.51
PABPC1 P11940 1/20 0.51
ALDH1A1 P00352 5/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TP53 P04637 1/20 0.50
HSP90AA1 P07900 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
SCHEMBL2791886 0.95 ABCB1 (0.61) NPC1RAB9APOLBMAPTMEN1
SCHEMBL24229481 0.93 NPC1 (0.75) NPC1RAB9APOLBMAPTMEN1
SCHEMBL31451575 0.93 NPC1 (0.75) NPC1RAB9APOLBMAPTMEN1
SCHEMBL1011248 0.89 PABPC1 (0.59) NPC1RAB9APOLBMAPTMEN1
SCHEMBL9702763 0.86 NPC1 (0.59) NPC1RAB9APOLBMAPTMEN1
SCHEMBL28242830 0.86 NPC1 (0.67) NPC1RAB9APOLBMAPTMEN1
SCHEMBL25389520 0.86 ALDH1A1 (0.66) NPC1RAB9APOLBMAPTMEN1
SCHEMBL1008997 0.86 NPC1 (0.58) NPC1RAB9APOLBMAPTMEN1
SCHEMBL5758552 0.84 NPC1 (0.60) NPC1RAB9APOLBMAPTMEN1
SCHEMBL15940145 0.82 NPC1 (0.51) NPC1RAB9APOLBMAPTMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040185299-A1 Tertiary diamines containing heterocyclic groups and their use in organic electroluminescent devices CDT OXFORD LIMITED (GB) 2004-09-23 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-20040185299-A1 Tertiary diamines containing heterocyclic groups and their use in organic electroluminescent devices AOC3, AOC1, NR4A1 NPC1 1425/4885RAB9A 1347/4885POLB 868/4885

“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.