SCHEMBL4530801

SCHEMBL4530801

CCc1cc(C(N)=O)ccc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.46
CHEK2 O96017 2/20 0.46
MKNK2 Q9HBH9 2/20 0.45
BCAT2 O15382 1/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
PARP1 P09874 3/20 0.44
MAPT P10636 2/20 0.44
POLB P06746 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
DHODH Q02127 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
PLA2G10 O15496 1/20 0.43
PLA2G2A P14555 1/20 0.43

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
SCHEMBL2635961 0.86 BCL2 (0.50) L3MBTL1MAPTPOLBSMN1; SMN2SRD5A2
SCHEMBL28188264 0.85 CHEK2 (0.44) MKNK1CHEK2MKNK2BCAT2L3MBTL1
SCHEMBL14720212 0.85 PLA2G2A (0.59) MKNK1CHEK2MKNK2BCAT2L3MBTL1
SCHEMBL30556643 0.85 CHEK2 (0.44) MKNK1CHEK2MKNK2BCAT2L3MBTL1
SCHEMBL1002755 0.85 RARB (0.46) MAPTKMT2AHPGDMEN1
SCHEMBL4444932 0.85 CSNK2A2 (0.46) L3MBTL1PARP1MAPTPOLBCYP3A4
SCHEMBL9751648 0.82 BCL2 (0.58) L3MBTL1MAPTSMN1; SMN2SRD5A2HPGD
SCHEMBL21724400 0.81 BCAT2 (0.44) MKNK1CHEK2MKNK2BCAT2L3MBTL1
SCHEMBL4664597 0.81 EGFR (0.60) L3MBTL1MAPTTSHRKMT2AHPGD
SCHEMBL2026663 0.80 L3MBTL1 (0.52) MKNK1CHEK2MKNK2BCAT2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1826121-B Application of phenyl and pyridyl derivatives in preparation of drugs for regulating calcium ion release and activating calcium ion channels SYNTA PHARMACEUTICALS CORP 2013-05-29 CN claimed
CN-102793692-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP 2012-11-28 CN claimed
CN-101947218-A The method of modulating calcium ion-release-activated calcium ion channels SYNTA PHARMACEUTICALS CORP 2011-01-19 CN claimed
CN-1826121-A Method for regulating and controlling calcium ion release to activate calcium ion channel SYNTA PHARMACEUTICALS CORP (US) 2006-08-30 CN claimed
CN-1826120-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP (US) 2006-08-30 CN claimed
CN-1826121-B Application of phenyl and pyridyl derivatives in preparation of drugs for regulating calcium ion release and activating calcium ion channels SYNTA PHARMACEUTICALS CORP 2013-05-29 CN disclosed
CN-102793692-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP 2012-11-28 CN disclosed
US-8084615-B2 Antibacterial agents UNIVERSITY OF WASHINGTON (US) 2011-12-27 US disclosed
CN-101947218-A The method of modulating calcium ion-release-activated calcium ion channels SYNTA PHARMACEUTICALS CORP 2011-01-19 CN disclosed
US-20090163496-A1 ANTIBACTERIAL AGENTS UNIVERSITY OF WASHINGTON (US) 2009-06-25 US disclosed
CN-1826121-A Method for regulating and controlling calcium ion release to activate calcium ion channel SYNTA PHARMACEUTICALS CORP (US) 2006-08-30 CN disclosed
CN-1826120-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP (US) 2006-08-30 CN 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-20090163496-A1 ANTIBACTERIAL AGENTS MRPL21, SI, PGLS MKNK1 2816/4885CHEK2 4463/4885MKNK2 3634/4885

“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.