SCHEMBL1704097

SCHEMBL1704097

CCC(Cl)C(=O)Nc1ccsc1C(=O)Nc1cc(F)cc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PKM P14618 2/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
F10 P00742 1/20 0.40
LMNA P02545 3/20 0.39
HPGD P15428 3/20 0.39
GAA P10253 1/20 0.39
KDR P35968 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
RECQL P46063 1/20 0.37
MAPT P10636 2/20 0.37
ABCC1 P33527 1/20 0.37
ABCB1 P08183 2/20 0.36
FLT1 P17948 2/20 0.36

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
SCHEMBL1703806 0.84 L3MBTL1 (0.51) MEN1KMT2APKMALDH1A1L3MBTL1
SCHEMBL1703499 0.83 PKM (0.52) MEN1KMT2APKMALDH1A1L3MBTL1
SCHEMBL1703558 0.82 MAPT (0.56) MEN1KMT2APKMALDH1A1L3MBTL1
SCHEMBL1703658 0.80 RAB9A (0.52) MEN1KMT2APKMALDH1A1L3MBTL1
SCHEMBL1703451 0.79 MEN1 (0.45) MEN1KMT2APKMKDM4EALDH1A1
SCHEMBL1704203 0.78 L3MBTL1 (0.46) KMT2AKDM4EALDH1A1L3MBTL1LMNA
SCHEMBL1703690 0.76 PKM (0.45) MEN1KMT2APKMKDM4EALDH1A1
SCHEMBL1703491 0.70 LMNA (0.49) MEN1KMT2APKMALDH1A1L3MBTL1
SCHEMBL1703430 0.70 RXFP1 (0.44) MEN1KMT2APKMKDM4EALDH1A1
SCHEMBL7533361 0.68 ACLY (0.48) MEN1KMT2AKDM4EALDH1A1LMNA

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
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
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 2910/4885PKM 3015/4885

“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.