SCHEMBL23891729

SCHEMBL23891729

CC(=O)CN1C(=O)OC2(CC3(CC3)c3cc(N)ccc32)C1=O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 18/20 0.33
CREBBP Q92793 9/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2C9 P11712 1/20 0.33
GABRA1 P14867 2/20 0.32
TMEM97 Q5BJF2 2/20 0.32
SLC6A4 P31645 1/20 0.32
HTR2B P41595 1/20 0.32
SLC6A3 Q01959 1/20 0.32
PLK3 Q9H4B4 1/20 0.32
DRD3 P35462 1/20 0.31
FSHR P23945 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL23891742 0.89 TSHR (0.34) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL22040148 0.86 NR1H2 (0.35) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL23891706 0.82
SCHEMBL23891707 0.81 EP300 (0.49) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL23891583 0.81 EP300 (0.46) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL22039460 0.76 EP300 (0.61) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL23891672 0.74 CCKBR (0.34) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL22039746 0.73 EP300 (0.50) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL22039716 0.73 EP300 (0.50) EP300CREBBPCYP3A4CYP2C8CYP2C9
SCHEMBL22039456 0.73 BACE1 (0.38) EP300CREBBPCYP3A4CYP2C8CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed