SCHEMBL4021234

SCHEMBL4021234

Cc1c(F)cccc1C1[C@@H](C(=O)c2cccc(O)c2)CN(CCN(C)S(=O)(=O)N(C)C)C[C@@H]1C(=O)c1cccc(O)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 8/20 0.33
OPRM1 P35372 7/20 0.33
PKM P14618 1/20 0.32
KDM2B Q8NHM5 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
OPRK1 P41145 5/20 0.31
BCHE P06276 1/20 0.31
HTR7 P34969 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL4028045 0.92 OPRM1 (0.35) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL13721487 0.92 OPRM1 (0.35) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4028041 0.92 OPRM1 (0.35) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4029041 0.90 KDM4E (0.38) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4772539 0.90 OPRM1 (0.34) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4751548 0.90 OPRM1 (0.34) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4751549 0.90 OPRM1 (0.34) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4027446 0.88 OPRM1 (0.35) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4027439 0.88 OPRM1 (0.35) OPRD1OPRM1KDM2BMEN1KMT2A
SCHEMBL4774673 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US claimed
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 OPRD1 4504/4885OPRM1 4219/4885PKM 1522/4885

“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.