SCHEMBL4759715

SCHEMBL4759715

CC(=O)Nc1nc2c(s1)C(=O)C(C(=O)c1ccc(N(C)C)nc1)OC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 12/20 0.39
OGA O60502 2/20 0.38
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
PIK3CA P42336 3/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CB P42338 1/20 0.36
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL4759713 0.91 PIK3CG (0.35) PIK3CGOGALMNAGAAMAPT
SCHEMBL2690337 0.87 LMNA (0.35) PIK3CGOGALMNAGAAMAPT
SCHEMBL2690832 0.87 OGA (0.38) PIK3CGOGALMNAGAAMAPT
SCHEMBL2688914 0.85 PIK3CG (0.46) PIK3CGOGALMNAGAAMAPT
SCHEMBL2690998 0.83 LMNA (0.34) PIK3CGOGALMNAGAAMAPT
SCHEMBL4759717 0.83 HCAR3 (0.33) ALDH1A1MAPK1HSD17B10
SCHEMBL2692071 0.82 PIK3CG (0.46) PIK3CGLMNAGAAMAPTHPGD
SCHEMBL4759320 0.81 LMNA (0.40) PIK3CGOGALMNAGAAMAPT
SCHEMBL12598910 0.81 ALDH1A1 (0.39) PIK3CGOGALMNAGAAMAPT
SCHEMBL2691004 0.77 LMNA (0.35) PIK3CGOGALMNAGAAMAPT

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-9243000-B2 Thia-triaza-indacenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-01-26 US disclosed
US-20120108618-A1 THIA-TRIAZA-INDACENES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 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-20120108618-A1 THIA-TRIAZA-INDACENES CCNA1, MKI67, CCNT1 PIK3CG 4396/4885OGA 2113/4885LMNA 1287/4885

“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.