SCHEMBL7715912

SCHEMBL7715912

CC(C)(C)C(OC(=O)CC(=O)OC(C(C)(C)C)C(C)(C)C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.36
GAA P10253 2/20 0.36
SI P14410 2/20 0.36
MGAM2 Q2M2H8 2/20 0.36
CYP2D6 P10635 1/20 0.35
TSHR P16473 3/20 0.33
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MMP13 P45452 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TET2 Q6N021 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL7715916 0.88 LDHA (0.35) GAACYP2D6TSHRCYP2C19MMP1
SCHEMBL22615652 0.81 TET2 (0.38) CYP2D6HSD17B10TET2
SCHEMBL22615833 0.80 TRPA1 (0.41) CYP2C19
SCHEMBL6429917 0.77 CYP2D6 (0.38) MGAMGAASIMGAM2CYP2D6
SCHEMBL22615873 0.77 CYP2D6 (0.40) CYP2D6CA1CA2CA7
SCHEMBL14197790 0.77 CYP1A2 (0.33) MMP1MMP2MMP3MMP9MMP13
SCHEMBL28871072 0.75 MGAM (0.33) MGAMGAASIMGAM2CYP2D6
SCHEMBL14338617 0.74 ABHD6 (0.33) MGAMGAASIMGAM2CA1
SCHEMBL22615680 0.73 PAM (0.30)
SCHEMBL28218296 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6376632-B1 NORBORNENE COMPOUND CONTAINING CARBOXY GROUPS HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) 2002-04-23 US claimed