SCHEMBL5636044

SCHEMBL5636044

COCCN1C[C@H](C(=O)c2ccccc2)[C@@H](c2cccc(F)c2C)[C@H](C(=O)N(C)CCOC)C1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.39
EED O75530 1/20 0.36
NTRK1 P04629 4/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 2/20 0.33
ACKR3 P25106 3/20 0.33
F10 P00742 1/20 0.33
CARM1 Q86X55 1/20 0.33
GAA P10253 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM2B Q8NHM5 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
SCHEMBL4026815 0.92 MC4R (0.40) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4780053 0.91 MC4R (0.44) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4019465 0.88 MC4R (0.42) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4019468 0.88 MC4R (0.42) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4751807 0.88 MC4R (0.42) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4021775 0.87 NPC1 (0.35) MC4REEDNTRK1NPC1ACKR3
SCHEMBL4749170 0.85 MC4R (0.40) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4029258 0.85 MC4R (0.40) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4776626 0.83 MC4R (0.44) MC4RNTRK1KMT2AMEN1KDM4E
SCHEMBL4776650 0.83 MC4R (0.44) MC4RNTRK1KMT2AMEN1KDM4E

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-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US claimed

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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 MC4R 3874/4885EED 1022/4885NTRK1 3738/4885

“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.