SCHEMBL7141709

SCHEMBL7141709

CC(C)(C)OC(=O)N1CCC(C(O)C(=O)O)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.51
GPR119 Q8TDV5 2/20 0.49
RECQL P46063 1/20 0.49
EPHX1 P07099 1/20 0.49
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MMP13 P45452 7/20 0.47
EED O75530 1/20 0.47
RBBP4 Q09028 1/20 0.47
SUZ12 Q15022 1/20 0.47
EZH2 Q15910 1/20 0.47
AEBP2 Q6ZN18 1/20 0.47
DPP4 P27487 1/20 0.47
MMP1 P03956 3/20 0.46
MMP3 P08254 3/20 0.46
MMP7 P09237 3/20 0.46
MMP9 P14780 3/20 0.46
MMP8 P22894 3/20 0.46
MMP2 P08253 2/20 0.46
NPC1 O15118 1/20 0.45

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
SCHEMBL4612534 0.85 HPGD (0.53) HPGDGPR119RECQLEPHX1USP2
SCHEMBL19560047 0.85 HPGD (0.55) HPGDGPR119RECQLEPHX1USP2
SCHEMBL21995290 0.84 HPGD (0.49) HPGDGPR119RECQLEPHX1USP2
SCHEMBL1422213 0.84 HPGD (0.51) HPGDGPR119RECQLEPHX1USP2
SCHEMBL7493781 0.84 HPGD (0.51) HPGDGPR119RECQLEPHX1USP2
SCHEMBL387237 0.83 HPGD (0.54) HPGDGPR119RECQLEPHX1USP2
SCHEMBL4523020 0.83 HPGD (0.54) HPGDGPR119RECQLEPHX1USP2
SCHEMBL470530 0.83 HPGD (0.54) HPGDGPR119RECQLEPHX1USP2
SCHEMBL20600888 0.83 HPGD (0.54) HPGDGPR119RECQLEPHX1USP2
SCHEMBL570862 0.83 NR1H2 (0.47) HPGDGPR119RECQLEPHX1USP2

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
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
US-5973188-A Acetic acid derivatives HOFFMANN-LA ROCHE INC. (US) 1999-10-26 US disclosed
US-5726185-A BINDING OF ADHESIVE PROTEINS TO BLOOD PLATELET AGGREGATION AND CELL TO CELL ADHESION HOFFMANN-LA ROCHE INC. (US) 1998-03-10 US disclosed