SCHEMBL437167

SCHEMBL437167

COC(=O)CNC(=O)c1cccc(-c2ccccc2)c1C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 8/20 0.49
CD274 Q9NZQ7 8/20 0.49
CHRNB2 P17787 2/20 0.48
CHRNA4 P43681 2/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
MAPK1 P28482 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SUCNR1 Q9BXA5 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
KEAP1 Q14145 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GAA P10253 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
SCHEMBL8947154 0.88 CHRNB2 (0.60) PDCD1CD274CHRNB2CHRNA4CHRNB4
SCHEMBL436284 0.87 KEAP1 (0.57) PDCD1CD274CHRNB2CHRNA4CHRNB4
SCHEMBL449968 0.82 HDAC3 (0.51) PDCD1CD274MAPK1
SCHEMBL30402499 0.79 SUCNR1 (0.51) PDCD1CD274CHRNB2CHRNA4CHRNB4
SCHEMBL28254835 0.79 SUCNR1 (0.51) PDCD1CD274CHRNB2CHRNA4CHRNB4
SCHEMBL7697059 0.79 CHRNB2 (0.56) PDCD1CD274CHRNB2CHRNA4CHRNB4
SCHEMBL436252 0.78 KMT2A (0.44) MAPK1MEN1KMT2AKDM4EGAA
SCHEMBL5533081 0.77 PDCD1 (0.60) PDCD1CD274MEN1KMT2A
SCHEMBL29256186 0.77 HDAC7 (0.59) PDCD1CD274CHRNB2CHRNA4CHRNB4
SCHEMBL29918042 0.77 PDCD1 (0.60) PDCD1CD274MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716326-B2 Isoindolinone derivatives, preparation method thereof and a pharmaceutical composition comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2014-05-06 US disclosed
US-20120065396-A1 ISOINDOLINONE DERIVATIVES, PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-03-15 US 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-20120065396-A1 ISOINDOLINONE DERIVATIVES, PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION COMPRISING SAME PPIP5K2, SOST, ALPL PDCD1 746/4885CD274 2842/4885CHRNB2 4752/4885

“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.