SCHEMBL4777487

SCHEMBL4777487

CCCOc1ccc(/C=C/[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)NC)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
AKR1C3 P42330 1/20 0.41
CNR2 P34972 1/20 0.40
CENPE Q02224 1/20 0.40
NOS2 P35228 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
MMP1 P03956 1/20 0.39
EED O75530 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CSNK2A1 P68400 2/20 0.38
KCNA3 P22001 1/20 0.38

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
SCHEMBL4776494 0.87 CENPE (0.54) MEN1KMT2AAKR1C3CENPENOS2
SCHEMBL4776493 0.87 CENPE (0.54) MEN1KMT2AAKR1C3CENPENOS2
SCHEMBL4776495 0.87 CENPE (0.54) MEN1KMT2AAKR1C3CENPENOS2
SCHEMBL4776505 0.67 MMP9 (0.52) PPARG
SCHEMBL4778789 0.65 LTA4H (0.55)
SCHEMBL566342 0.65 CSNK2A1 (0.55) MEN1KMT2ACSNK2A1
SCHEMBL4321455 0.64 CSNK2A1 (0.63) PPARGMEN1KMT2ACSNK2A1
SCHEMBL3704073 0.64 CTSC (0.54)
SCHEMBL3704071 0.64 CTSC (0.54)
SCHEMBL10976287 0.64 CSNK2A1 (0.62) MEN1KMT2AS1PR1KDM4ECSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219192-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-09-20 US claimed
EP-1942732-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP disclosed
US-20070219192-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-09-20 US disclosed
WO-2007056143-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 WO 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-20070219192-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 PPARG 2756/4885MEN1 1302/4885KMT2A 1501/4885

“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.