SCHEMBL463419

SCHEMBL463419

COc1cc(C(=O)NC2CCN(P(C)(C)=O)CC2)cc(OC)c1OC

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.57
OPRK1 P41145 1/20 0.57
MCHR1 Q99705 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
PKM P14618 1/20 0.55
POLB P06746 1/20 0.55
TSHR P16473 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPK10 P53779 1/20 0.53
MMP2 P08253 3/20 0.52
ANPEP P15144 3/20 0.52
TDP1 Q9NUW8 1/20 0.50
CXCR6 O00574 1/20 0.48
CXCR4 P61073 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SIRT5 Q9NXA8 1/20 0.48

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
SCHEMBL12065590 0.89 MAPK1 (0.56) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL15443874 0.86 MCHR1 (0.53) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL15871566 0.85 MCHR1 (0.52) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL3140700 0.82 POLB (0.77) MAPK1OPRK1MEN1KMT2APKM
SCHEMBL409810 0.80 MCHR1 (0.50) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL23347841 0.79 MCHR1 (0.49) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL463415 0.79 MAPK1 (0.74) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL12065589 0.78 EPHX1 (0.55) MAPK1OPRK1MCHR1MEN1KMT2A
SCHEMBL7339569 0.77 MEN1 (0.61) MAPK1OPRK1MEN1KMT2APKM
SCHEMBL11833305 0.76 SIGMAR1 (0.59) MAPK1OPRK1MEN1KMT2APOLB

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-20120065169-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 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-20120065169-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS NSUN2, UPF1, RTCB MAPK1 4345/4885OPRK1 2420/4885MCHR1 4395/4885

“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.