SCHEMBL21286010

SCHEMBL21286010

Cn1cc(-c2ccc(NC(=O)C(CNCCc3ccc(C#N)cc3)c3ccccc3)nc2)cn1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 20/20 0.77
CREBBP Q92793 2/20 0.77
CYP2C8 P10632 1/20 0.65
CYP2D6 P10635 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2B6 P20813 1/20 0.65
CYP2C19 P33261 1/20 0.65
KCNH2 Q12809 1/20 0.65

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
SCHEMBL21285724 0.96 EP300 (0.76) EP300CREBBPCYP2C8CYP2D6CYP2C9
SCHEMBL21285906 0.93 EP300 (0.78) EP300CREBBP
SCHEMBL21285863 0.92 EP300 (0.78) EP300CREBBP
SCHEMBL21285905 0.92 EP300 (0.80) EP300CREBBP
SCHEMBL21285970 0.91 EP300 (0.79) EP300CREBBP
SCHEMBL21285969 0.91 EP300 (0.78) EP300CREBBPCYP2C8CYP2D6CYP2C9
SCHEMBL21285926 0.91 EP300 (0.78) EP300CREBBPCYP2C8CYP2D6CYP2C9
SCHEMBL29322285 0.90 EP300 (0.75) EP300CREBBP
SCHEMBL29324254 0.90 EP300 (0.68) EP300CREBBP
SCHEMBL29324272 0.90 EP300 (0.70) EP300CREBBPCYP2C8CYP2D6CYP2C9

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
EP-3752497-B1 P300/CBP HAT INHIBITORS CONSTELLATION PHARMACEUTICALS INC (US) 2024-07-17 EP disclosed
WO-2019161162-A1 P300/CBP HAT INHIBITORS CONSTELLATION PHARMACEUTICALS, INC. (US) 2019-08-22 WO disclosed