SCHEMBL4025183

SCHEMBL4025183

Cc1cccc([C@H]2[CH]CN(CCN(C)C)C[C@@H]2C(=O)c2ccccc2)c1C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.37
HRH3 Q9Y5N1 2/20 0.37
ACHE P22303 1/20 0.34
P2RX7 Q99572 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RORC P51449 1/20 0.33
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
SLC6A1 P30531 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
SCHEMBL4019022 1.00 KIF11 (0.37) KIF11HRH3ACHEP2RX7KDM4E
SCHEMBL4025178 0.94 KIF11 (0.45) KIF11HRH3ACHEP2RX7ALDH1A1
SCHEMBL4024600 0.89 L3MBTL1 (0.34) KIF11ALDH1A1RORCSLC6A1
SCHEMBL4027448 0.89 KDM2B (0.37) KIF11ALDH1A1RORC
SCHEMBL4026679 0.89 L3MBTL1 (0.34) KIF11ALDH1A1RORCSLC6A1
SCHEMBL4026766 0.88 KIF11 (0.41) KIF11ALDH1A1RORCSLC6A1
SCHEMBL4021821 0.88 KIF11 (0.41) KIF11ALDH1A1RORCSLC6A1
SCHEMBL4027189 0.87 KCNH2 (0.35) KIF11ALDH1A1RORCSLC6A1
SCHEMBL4020571 0.87 KCNH2 (0.35) KIF11ALDH1A1RORCSLC6A1
SCHEMBL4028852 0.86 KCNH2 (0.37) KIF11ALDH1A1RORC

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 KIF11 3745/4885HRH3 1935/4885ACHE 2619/4885

“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.