SCHEMBL4028267

SCHEMBL4028267

Cc1cccc(C)c1[C@H]1[CH]CN(CCO)C[C@@H]1C(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
RORC P51449 1/20 0.36
SLC18A3 Q16572 1/20 0.35
SLC6A1 P30531 1/20 0.34
KMT2A Q03164 2/20 0.34
MAPK1 P28482 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
MEN1 O00255 1/20 0.34
KCNH2 Q12809 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HTR2A P28223 1/20 0.33
GAA P10253 1/20 0.33
CCR5 P51681 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL4026679 0.88 L3MBTL1 (0.34) L3MBTL1RORCSLC6A1KMT2AMAPK1
SCHEMBL4024600 0.88 L3MBTL1 (0.34) L3MBTL1RORCSLC6A1KMT2AMAPK1
SCHEMBL4028142 0.84 RORC (0.39) RORCSLC18A3KMT2AMEN1ALDH1A1
SCHEMBL4020295 0.84 PDE10A (0.36) L3MBTL1RORCSLC6A1ALDH1A1
SCHEMBL4026859 0.82 HTR1A (0.36) L3MBTL1RORCKMT2AMEN1KCNH2
SCHEMBL4027189 0.81 KCNH2 (0.35) RORCSLC6A1KMT2AKCNH2ALDH1A1
SCHEMBL4020571 0.81 KCNH2 (0.35) RORCSLC6A1KMT2AKCNH2ALDH1A1
SCHEMBL4028852 0.81 KCNH2 (0.37) RORCKMT2AKCNH2ALDH1A1HTR2A
SCHEMBL4022920 0.80 RORC (0.40) RORCSLC18A3KMT2ASLC6A2SLC6A3
SCHEMBL4021193 0.79 ALDH1A1 (0.37) RORCKMT2AMAPK1MEN1KCNH2

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 2 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 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 L3MBTL1 3696/4885RORC 183/4885SLC18A3 2628/4885

“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.