SCHEMBL14475460

SCHEMBL14475460

COc1ccc2nc(-c3cccnc3)nc(Nc3nc(-c4cccc(N)c4)cs3)c2c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 10/20 0.65
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ABCB1 P08183 2/20 0.55
MAPT P10636 4/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
ALOX12 P18054 1/20 0.48
KDM4E B2RXH2 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 2/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
PIK3CA P42336 1/20 0.46
KIT P10721 1/20 0.46

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
SCHEMBL14474455 0.93 MEN1 (0.62) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474150 0.92 ABCG2 (0.65) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474059 0.91 NPC1 (0.57) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474921 0.91 ABCG2 (0.60) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474024 0.90 RAB9A (0.56) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474424 0.90 ABCG2 (0.61) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474453 0.90 MAPT (0.56) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14726452 0.90 NPC1 (0.55) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474408 0.89 RAB9A (0.58) ABCG2NPC1RAB9AMEN1KMT2A
SCHEMBL14474494 0.88 ABCG2 (0.56) ABCG2NPC1RAB9AMEN1KMT2A

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-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL COMPANY (JP) 2013-02-28 US disclosed
WO-2013003586-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 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-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PPP3CB, PTPRG ABCG2 2822/4885NPC1 2982/4885RAB9A 1248/4885

“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.