SCHEMBL3317557

SCHEMBL3317557

CN(CCO)CCCC(N)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.39
KDM4C Q9H3R0 9/20 0.38
KDM5A P29375 7/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
MAPT P10636 1/20 0.36
CHRM2 P08172 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KDM5C P41229 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
PHF8 Q9UPP1 2/20 0.33
KDM4A O75164 2/20 0.33
FAAH O00519 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
SOAT1 P35610 1/20 0.32
PNP P00491 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
SCHEMBL4726264 0.91 CHRM2 (0.43) LTA4HKDM4CKDM5ATHRATHRB
SCHEMBL27972459 0.91 LTA4H (0.42) LTA4HKDM4CKDM5ACHRM2KMT2A
SCHEMBL3319751 0.88 KMT2A (0.41) LTA4HTHRATHRBMAPTKMT2A
SCHEMBL26495389 0.82 KDM4C (0.50) KDM4CKDM5AKDM5CKDM5BPHF8
SCHEMBL30074288 0.81 LTA4H (0.47) LTA4HKDM4CKDM5ACHRM2KMT2A
Carbamic Acid SCHEMBL9587573 0.80 MAPT (0.43) KDM4CKDM5ATHRATHRBMAPT
SCHEMBL8386761 0.80 KDM5A (0.51) KDM4CKDM5AKMT2AMEN1KDM5C
SCHEMBL3316660 0.79 KDM4C (0.47) LTA4HKDM4CKDM5AKMT2AMEN1
SCHEMBL29641947 0.78 S1PR2 (0.53) KDM4CKDM5AKMT2AMEN1KDM5C
SCHEMBL29641969 0.78 S1PR2 (0.53) KDM4CKDM5AKMT2AMEN1KDM5C

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-20100104659-A1 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2010-04-29 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-20100104659-A1 BENZOPYRANOPYRAZOLES BAX, BCL2, BAD LTA4H 3282/4885KDM4C 2767/4885KDM5A 3033/4885

“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.