SCHEMBL7453285

SCHEMBL7453285

CC[C@H]1CC(=O)N[C@@H]1C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.46
BRD4 O60885 1/20 0.46
TSHR P16473 1/20 0.44
HPGD P15428 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GPBAR1 Q8TDU6 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HTR2C P28335 1/20 0.41
FABP7 O15540 1/20 0.41
FABP5 Q01469 1/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL7506836 1.00 CREBBP (0.46) CREBBPBRD4TSHRHPGDALDH1A1
SCHEMBL7506825 1.00 CREBBP (0.46) CREBBPBRD4TSHRHPGDALDH1A1
SCHEMBL7453292 1.00 CREBBP (0.46) CREBBPBRD4TSHRHPGDALDH1A1
SCHEMBL7453297 1.00 CREBBP (0.46) CREBBPBRD4TSHRHPGDALDH1A1
SCHEMBL7453288 0.81 USP2 (0.41) CREBBPBRD4TSHRALDH1A1TP53
SCHEMBL7449138 0.80 KMT2A (0.43) HPGDALDH1A1MEN1KMT2A
SCHEMBL7512566 0.80 KMT2A (0.43) HPGDALDH1A1MEN1KMT2A
SCHEMBL9744632 0.80 KMT2A (0.43) HPGDALDH1A1MEN1KMT2A
SCHEMBL9745679 0.80 KMT2A (0.43) HPGDALDH1A1MEN1KMT2A
SCHEMBL6866934 0.79 TSHR (0.55) CREBBPBRD4TSHRHPGDALDH1A1

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-1140821-A1 LACTAMS ISIS INNOVATION LIMITED (GB) 2001-10-10 EP disclosed
WO-2000035871-A1 LACTAMS ISIS INNOVATION LIMITED (GB) 2000-06-22 WO disclosed