SCHEMBL9762008

SCHEMBL9762008

CC(=O)N1CCc2c(c(=O)c3ccc(C)nc3n2-c2cccc(Cl)c2)C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
BAZ2B Q9UIF8 6/20 0.44
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
BRD4 O60885 2/20 0.42
CREBBP Q92793 2/20 0.42
TP53 P04637 2/20 0.42
KMT2A Q03164 1/20 0.39

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
SCHEMBL9129169 0.85 BAZ2B (0.45) MAPTBAZ2BPOLBLMNABRD4
SCHEMBL9134935 0.76 MAPT (0.43) MAPTBAZ2BPOLBLMNATP53
SCHEMBL9131042 0.74 PTGDR2 (0.46) MAPTBAZ2BLMNABRD4CREBBP
SCHEMBL9761878 0.73 KCNK3 (0.50) MAPTPOLBBRD4CREBBPTP53
SCHEMBL9726939 0.68 MAPT (0.43) MAPTPOLBTP53KMT2A
SCHEMBL13197666 0.66 P2RX7 (0.65) KMT2A
SCHEMBL9129122 0.65 CLPP (0.51) KMT2A
SCHEMBL6009928 0.65 MAPT (0.49) MAPTKMT2A
SCHEMBL30438257 0.65 MAPT (0.49) MAPTKMT2A
SCHEMBL7083395 0.65 CREBBP (0.70) BAZ2BBRD4CREBBP

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
US-4988705-A Antiallergens and -inflammatory agents; hypotensive agents immunological suppression; hyperproliferative skin disorders such as psoriasis SCHERING CORPORATION (US) 1991-01-29 US claimed