SCHEMBL15033150

SCHEMBL15033150

Cc1ccc(C(=O)CSc2nnc(Cc3nn(C)c(=O)c4ccccc34)n2C)c(C)c1

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNKSR1 Q969H4 2/20 0.74
IL15 P40933 16/20 0.58
IL15RA Q13261 15/20 0.58
IL2 P60568 2/20 0.58
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
THRA P10827 1/20 0.51

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
SCHEMBL15811545 0.84 CNKSR1 (1.00) CNKSR1IL15IL15RAIL2THRA
SCHEMBL17293820 0.76 IL15 (0.69) CNKSR1IL15IL15RAIL2
SCHEMBL17293630 0.74 IL15 (0.63) CNKSR1IL15IL15RAIL2
SCHEMBL17293542 0.74 IL15 (1.00) IL15IL15RAIL2
SCHEMBL17293580 0.73 IL15 (1.00) CNKSR1IL15IL15RAIL2
SCHEMBL17293576 0.72 IL15 (0.82) CNKSR1IL15IL15RAIL2
SCHEMBL17293533 0.69 IL15 (0.58) CNKSR1IL15IL15RAIL2
SCHEMBL4203150 0.69 ALDH1A1 (0.64) NPC1RAB9A
SCHEMBL17293579 0.69 IL15 (0.76) CNKSR1IL15IL15RAIL2
SCHEMBL17293615 0.69 IL15 (1.00) IL15IL15RAIL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765797-B2 TG2 inhibitors and uses thereof BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-07-01 US disclosed
US-8765797-B2 TG2 inhibitors and uses thereof BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-07-01 US disclosed
US-20130158087-A1 TG2 INHIBITORS AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-06-20 US disclosed
US-20130158087-A1 TG2 INHIBITORS AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-06-20 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-20130158087-A1 TG2 INHIBITORS AND USES THEREOF TGM2, TGM3, GNMT CNKSR1 4453/4885IL15 4542/4885IL15RA 4284/4885

“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.