SCHEMBL1313864

SCHEMBL1313864

Cc1c(C(N)=O)c(C)n(CC(=O)NCC2CCNCC2)c1C=O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.37
TSHR P16473 2/20 0.37
EPHX1 P07099 1/20 0.34
EPHX2 P34913 1/20 0.34
KDM1A O60341 1/20 0.34
HTR4 Q13639 4/20 0.34
HTR3A P46098 1/20 0.34
F2 P00734 7/20 0.33
PRSS1 P07477 7/20 0.33
BDKRB2 P30411 1/20 0.33
BDKRB1 P46663 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRM1 P11229 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL1313862 0.83 ALOX15 (0.36) ALOX15TSHREPHX1EPHX2KDM1A
SCHEMBL1313251 0.82 PIM1 (0.37) KDM1AHDAC1
SCHEMBL1312671 0.82 KCNH2 (0.33) TSHRF2LMNAMAPK1
SCHEMBL17104265 0.79 CHRM1 (0.34) TSHRLMNACHRM1
SCHEMBL1312800 0.72 ACKR3 (0.41)
SCHEMBL1313644 0.71 KDM4E (0.43) TSHRLMNAMAPK1
SCHEMBL28790889 0.69 PIM1 (0.35)
SCHEMBL1312777 0.68 PARP1 (0.35) ALOX15LMNA
SCHEMBL1313751 0.66 PARP1 (0.34)
SCHEMBL1312670 0.66 F2 (0.34) TSHRF2LMNA

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 ALOX15 1572/4885TSHR 3739/4885EPHX1 1512/4885

“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.