SCHEMBL8624715

SCHEMBL8624715

COC(=Cc1ccccc1)C(=O)C=Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.55
ALDH1A1 P00352 3/20 0.53
GLA P06280 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
CMA1 P23946 2/20 0.51
MAPT P10636 3/20 0.50
HDAC3 O15379 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
PLIN1 O60240 2/20 0.50
LMNA P02545 2/20 0.50
RECQL P46063 2/20 0.50
PLIN5 Q00G26 2/20 0.50
ABHD5 Q8WTS1 2/20 0.50
TNKS O95271 1/20 0.50
HCAR2 Q8TDS4 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50

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
SCHEMBL8624713 1.00 ABCG2 (0.55) ABCG2ALDH1A1GLATDP1CMA1
SCHEMBL2016372 0.85 XDH (0.54) ABCG2ALDH1A1GLATDP1MAPT
SCHEMBL29115668 0.83 MAPT (0.50) ABCG2ALDH1A1GLATDP1MAPT
E-Methyl Cinnamate SCHEMBL31013356 0.82 CA12 (0.54) ABCG2ALDH1A1GLATDP1CMA1
SCHEMBL10348918 0.82 KMT2A (0.57) ALDH1A1GLATDP1MAPTHDAC3
SCHEMBL29115842 0.81 MAPT (0.48) ABCG2ALDH1A1GLATDP1MAPT
SCHEMBL2705826 0.80 ALDH1A1 (0.57) ALDH1A1GLATDP1CMA1MAPT
SCHEMBL2705827 0.80 ALDH1A1 (0.57) ALDH1A1GLATDP1CMA1MAPT
SCHEMBL10348194 0.80 CA1 (0.44) ABCG2ALDH1A1MAPTHDAC3HDAC1
SCHEMBL83065 0.80 AKR1C3 (0.55) ABCG2ALDH1A1RECQLCYP2C9SMN1; SMN2

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
EP-0223373-B1 WATER-SOLUBLE PHOTOINITIATORS AUTOTYPE INTERNATIONAL LIMITED (GB) 1990-04-18 EP claimed
CN-115803067-B Absorbent articles including HIPE foam reinforced with clay nanoplatelets and methods of manufacture 宝洁公司 2024-09-13 CN disclosed
EP-0845116-A1 WATER-LESS LITHOGRAPHIC PLATES HORSELL GRAPHIC INDUSTRIES LIMITED (GB) 1998-06-03 EP disclosed
WO-1997007430-A1 WATER-LESS LITHOGRAPHIC PLATES HORSELL GRAPHIC INDUSTRIES LIMITED (GB) 1997-02-27 WO disclosed