SCHEMBL4027448

SCHEMBL4027448

CCCN1C[CH][C@H](c2cccc(C)c2C)[C@@H](C(=O)c2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 6/20 0.37
KCNH2 Q12809 1/20 0.37
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.34
DRD3 P35462 1/20 0.34
KIF11 P52732 1/20 0.34
RORC P51449 1/20 0.34

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 0.91 L3MBTL1 (0.34) KCNH2KMT2AALDH1A1MEN1KIF11
SCHEMBL4024600 0.91 L3MBTL1 (0.34) KCNH2KMT2AALDH1A1MEN1KIF11
SCHEMBL4026766 0.90 KIF11 (0.41) KCNH2KMT2AALDH1A1LMNAMEN1
SCHEMBL4021821 0.90 KIF11 (0.41) KCNH2KMT2AALDH1A1LMNAMEN1
SCHEMBL4027189 0.89 KCNH2 (0.35) KCNH2KMT2AALDH1A1LMNAKIF11
SCHEMBL4020571 0.89 KCNH2 (0.35) KCNH2KMT2AALDH1A1LMNAKIF11
SCHEMBL4026061 0.89 KIF11 (0.43) KCNH2KMT2AALDH1A1LMNAMEN1
SCHEMBL4025183 0.89 KIF11 (0.37) ALDH1A1KIF11RORC
SCHEMBL4019022 0.89 KIF11 (0.37) ALDH1A1KIF11RORC
SCHEMBL4028852 0.89 KCNH2 (0.37) KCNH2KMT2AALDH1A1LMNAKIF11

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 KDM2B 3090/4885KCNH2 3099/4885KMT2A 2820/4885

“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.