SCHEMBL4661260

SCHEMBL4661260

COC(=O)C(Cl)(Cl)CCCCCCCCC(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 2/20 0.44
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.38
CNR2 P34972 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
CTBP2 P56545 1/20 0.36

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
SCHEMBL4659889 0.88 HDAC3 (0.49) ALDH1A1L3MBTL1HDAC3HDAC4HDAC1
SCHEMBL3673780 0.88 HDAC3 (0.43) L3MBTL1HDAC3HDAC4HDAC1HDAC7
SCHEMBL4661142 0.83 VNN1 (0.42) VNN1L3MBTL1MAPTCNR2HDAC3
SCHEMBL4661128 0.83 HDAC3 (0.48) ALDH1A1L3MBTL1POLBHDAC3HDAC4
SCHEMBL4659908 0.81 HDAC8 (0.45) ALDH1A1L3MBTL1MAPTPOLBHDAC3
SCHEMBL4659918 0.77 PPARA (0.38) ALDH1A1POLBCNR2KMT2A
SCHEMBL4661240 0.76 HTR1A (0.39) L3MBTL1POLBHDAC3HDAC4HDAC1
SCHEMBL4659864 0.76 HDAC3 (0.41) L3MBTL1HDAC3HDAC4HDAC1HDAC7
SCHEMBL4659891 0.75 GAA (0.47) L3MBTL1POLBCNR2MEN1KMT2A
SCHEMBL11566538 0.74 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTPOLBEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1627866-B1 CARBOXYLIC ACID COMPOUND AND MEDICINE CONTAINING THE SAME KOWA CO (JP) 2008-12-24 EP disclosed
US-7109242-B2 Carboxylic compound and medicine comprising the same KOWA COMPANY, LTD. (JP) 2006-09-19 US disclosed
EP-1627866-A1 CARBOXYLIC ACID COMPOUND AND MEDICINE CONTAINING THE SAME Kowa Company Ltd. (JP) 2006-02-22 EP disclosed