SCHEMBL6556282

SCHEMBL6556282

CCOC(Cn1c(-c2ccc(C)cc2)ncc(C(=O)O)c1=O)OCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.38
GAA P10253 6/20 0.38
ALDH1A1 P00352 4/20 0.38
PKM P14618 1/20 0.38
GLA P06280 2/20 0.38
KMT2A Q03164 2/20 0.37
HPGD P15428 2/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PPARD Q03181 2/20 0.36
PPARA Q07869 1/20 0.36
TARBP2 Q15633 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 2/20 0.35

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
SCHEMBL6556361 0.92 MAPT (0.42) KDM4EALDH1A1KMT2AHPGDMEN1
SCHEMBL6556234 0.91 ELANE (0.39) KDM4EGAAALDH1A1PPARDGABRA2
SCHEMBL6557511 0.91 P2RX3 (0.41) KDM4EALDH1A1KMT2AHPGDTDP1
SCHEMBL6558138 0.90 KDM4E (0.50) KDM4EGAAALDH1A1KMT2AMEN1
SCHEMBL6558338 0.90 KDM4E (0.50) KDM4EGAAALDH1A1PKMGLA
SCHEMBL6556504 0.90 CSNK1D (0.37) KDM4EGAAALDH1A1PKMGLA
SCHEMBL6557546 0.88 CTRC (0.42) KDM4EGAAALDH1A1PKMGLA
SCHEMBL6558245 0.87 MAPT (0.40) KDM4EALDH1A1KMT2AMEN1NPC1
SCHEMBL6558315 0.84 MEN1 (0.42) KDM4EALDH1A1KMT2AMEN1NPC1
SCHEMBL7152432 0.83 MAPT (0.41) KDM4EALDH1A1KMT2AMEN1CYP1A2

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-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
US-5948785-A USEFUL AS CHYMASE INHIBITORS AND CAN BE EFFECTIVE FOR THE PROPHYLAXIS AND TREATMENT OF VARIOUS DISEASES CAUSED BY CHYMASE, SUCH AS THOSE CAUSED BY ANGIOTENSIN II. THE GREEN CROSS CORPORATION (JP) 1999-09-07 US disclosed
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed