SCHEMBL4995076

SCHEMBL4995076

COC(=O)c1cccn(Cc2ccc(C(C)C)cc2)c1=O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.56
ALDH1A1 P00352 4/20 0.56
MAPT P10636 4/20 0.54
POLB P06746 2/20 0.54
BRD4 O60885 2/20 0.52
BRD2 P25440 1/20 0.52
BRD3 Q15059 1/20 0.52
BRDT Q58F21 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.47
CNR1 P21554 3/20 0.46
CNR2 P34972 3/20 0.46
TP53 P04637 2/20 0.46
VEGFA P15692 1/20 0.45
EGLN1 Q9GZT9 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL4817512 0.85 CNR1 (0.59) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL4992841 0.85 BRD4 (0.56) KDM4EALDH1A1MAPTBRD4BRD2
SCHEMBL1137191 0.85 BRD4 (0.70) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL4429575 0.84 KDM4E (0.55) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL4983592 0.83 BRD4 (0.67) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL4992963 0.83 BRD4 (0.60) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL12120841 0.81 KDM4E (0.53) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL4425995 0.81 MAPT (0.56) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL4992274 0.81 MAPT (0.78) KDM4EALDH1A1MAPTPOLBBRD4
SCHEMBL13306800 0.79 MAPT (0.56) KDM4EALDH1A1MAPTPOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188528-A1 Modulators of C3a receptor and methods of use thereof ENCYSIVE PHARMACEUTICALS, INC. 2008-08-07 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-20080188528-A1 Modulators of C3a receptor and methods of use thereof C3AR1, C5, C5AR1 KDM4E 2635/4885ALDH1A1 1639/4885MAPT 4654/4885

“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.