SCHEMBL1313872

SCHEMBL1313872

Cc1[nH]c(C=O)c(C)c1C(=O)NCC(=O)NCC1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.42
PDGFRB P09619 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 1/20 0.39
CHRM1 P11229 9/20 0.35
CHRM3 P20309 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
HTR4 Q13639 2/20 0.34
EPHX1 P07099 1/20 0.33
EPHX2 P34913 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL1313247 0.92 PDGFRB (0.43) PDGFRBFGFR1KDRALOX15TSHR
SCHEMBL1313859 0.81 PYGL (0.41) PDGFRBFGFR1KDRTSHRCHRM1
SCHEMBL12117597 0.76 PDGFRB (0.74) PDGFRBFGFR1KDRCHRM1CHRM3
SCHEMBL1312318 0.76 DRD2 (0.49) TSHRALDH1A1
SCHEMBL1312796 0.73 ACKR3 (0.41) PDGFRBFGFR1KDRTSHRCHRM4
SCHEMBL1312775 0.71 DRD2 (0.41) PDGFRBFGFR1KDRTSHRALDH1A1
SCHEMBL1313746 0.70 GAA (0.41) KDM1AKDRTSHREPHX1
Hydrochloric Acid SCHEMBL27754601 0.70 ALOX15 (0.54) KDM1AALOX15TSHRCHRM1CHRM3
SCHEMBL1312667 0.69 PYGL (0.36) PDGFRBFGFR1KDRTSHRCHRM1
SCHEMBL7126911 0.67 PDGFRB (0.42) PDGFRBFGFR1KDRALDH1A1

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-2292613-B1 DIHYDROINDOLINONE DERIVATIVES SHANGHAI INST PHARM INDUSTRY (CN) 2015-09-30 EP disclosed
US-8829039-B2 Dihydroindolinone derivatives SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2014-09-09 US disclosed
US-20110275671-A1 DIHYDROINDOLINONE DERIVATIVES Shanghai Institute of Pharmaceutical Indusrty (CN) 2011-11-10 US disclosed
EP-2292613-A1 DIHYDROINDOLINONE DERIVATIVES Shanghai Institute of Pharmaceutical Industry (CN) 2011-03-09 EP 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-20110275671-A1 DIHYDROINDOLINONE DERIVATIVES LCK, CDK5, ABL1 KDM1A 2359/4885PDGFRB 195/4885FGFR1 17/4885

“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.