SCHEMBL1704322

SCHEMBL1704322

Cc1cccc(NC(=O)c2sccc2NC(=O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
MAPT P10636 3/20 0.63
POLB P06746 2/20 0.63
PKM P14618 1/20 0.63
RAB9A P51151 3/20 0.55
ALDH1A1 P00352 3/20 0.55
TP53 P04637 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 2/20 0.54
RXFP1 Q9HBX9 2/20 0.54
GAA P10253 1/20 0.52
KCNK3 O14649 3/20 0.50
KCNK9 Q9NPC2 3/20 0.50
KCNH2 Q12809 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
HSD17B10 Q99714 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
SCHEMBL1704320 0.85 RAB9A (0.61) MEN1KMT2AMAPTPOLBPKM
SCHEMBL1704235 0.85 LMNA (0.54) MEN1KMT2AMAPTPKMRAB9A
SCHEMBL1704103 0.82 RAB9A (0.60) MEN1KMT2AMAPTPKMRAB9A
SCHEMBL1703558 0.82 MAPT (0.56) MEN1KMT2AMAPTPOLBPKM
SCHEMBL1703648 0.82 RAB9A (0.56) MEN1KMT2AMAPTPOLBPKM
SCHEMBL1703451 0.77 MEN1 (0.45) MEN1KMT2AMAPTPKMRAB9A
SCHEMBL1704052 0.77 ALDH1A1 (0.49) MEN1KMT2AMAPTPOLBPKM
SCHEMBL1703359 0.77 LMNA (0.55) MEN1KMT2AMAPTPOLBPKM
SCHEMBL692386 0.77 HSD17B10 (0.74) MEN1KMT2APOLBPKMALDH1A1
SCHEMBL30762995 0.77 HSD17B10 (0.74) MEN1KMT2APOLBPKMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2441768-A1 Thienopyrimidinones for treatment of inflammatory disorders and cancers Eli Lilly & Co. (US) 2012-04-18 EP disclosed
US-20100216820-A1 THIENOPYRIMIDIONES FOR TREATMENT OF INFLAMMATORY DISORDERS AND CANCERS ICOS CORPORATION 2010-08-26 US disclosed
CN-101605797-A The Thienopyrimidinones of treatment inflammatory disease and cancer LILLY CO ELI (US) 2009-12-16 CN disclosed
EP-2097422-A1 THIENOPYRIMIDINONES FOR TREATMENT OF INFLAMMATORY DISORDERS AND CANCERS Eli Lilly & Co. (US) 2009-09-09 EP disclosed
WO-2008064018-A1 THIENOPYRIMIDINONES FOR TREATMENT OF INFLAMMATORY DISORDERS AND CANCERS ELI LILLY & CO. (US) 2008-05-29 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-20100216820-A1 THIENOPYRIMIDIONES FOR TREATMENT OF INFLAMMATORY DISORDERS AND CANCERS PIK3CA, PIK3CD, PIK3CB MEN1 1392/4885KMT2A 2910/4885MAPT 4638/4885

“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.