SCHEMBL3690697

SCHEMBL3690697

CC(C)(Cn1ccnc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 12/20 0.64
ALDH1A1 P00352 1/20 0.55
EGLN3 Q9H6Z9 1/20 0.52
FDPS P14324 2/20 0.51
GGPS1 O95749 3/20 0.50
BTN3A1 O00481 1/20 0.50
CA12 O43570 1/20 0.50
CA2 P00918 1/20 0.50
LMNA P02545 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP14 P50281 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47

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
SCHEMBL4968502 0.85 FDPS (0.51) TBXAS1ALDH1A1EGLN3FDPSGGPS1
SCHEMBL10655960 0.81 TBXAS1 (0.88) TBXAS1EGLN3
SCHEMBL27461167 0.80 TBXAS1 (0.67) TBXAS1ALDH1A1EGLN3FDPSGGPS1
SCHEMBL11275678 0.79 TBXAS1 (1.00) TBXAS1
SCHEMBL4682917 0.78 FDPS (0.52) TBXAS1ALDH1A1EGLN3FDPSGGPS1
SCHEMBL4241305 0.78 FDPS (0.56) TBXAS1ALDH1A1EGLN3FDPSGGPS1
Hydrochloric Acid SCHEMBL11267409 0.77 TBXAS1 (1.00) TBXAS1
SCHEMBL2697302 0.77 CYP11B1 (0.50) TBXAS1ALDH1A1FDPSGGPS1BTN3A1
SCHEMBL19200881 0.74 FDPS (0.49) TBXAS1ALDH1A1EGLN3FDPSGGPS1
SCHEMBL11161842 0.74 TBXAS1 (1.00) TBXAS1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131052-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases MATIER WILLIAM L (US) 2013-05-23 US disclosed
US-20130131052-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases MATIER WILLIAM L (US) 2013-05-23 US disclosed
US-8383648-B2 Applying such as 1-oxyl-4-(3'-ethoxy-2',2'-dimethyl)propanecarbonyloxy-2,2,6,6-tetramethylpiperidine to eye surface; halting growth, preventing surgery COLBY PHARMACEUTICAL COMPANY (US) 2013-02-26 US disclosed
US-8383648-B2 Applying such as 1-oxyl-4-(3'-ethoxy-2',2'-dimethyl)propanecarbonyloxy-2,2,6,6-tetramethylpiperidine to eye surface; halting growth, preventing surgery COLBY PHARMACEUTICAL COMPANY (US) 2013-02-26 US disclosed
US-8383648-B2 Applying such as 1-oxyl-4-(3'-ethoxy-2',2'-dimethyl)propanecarbonyloxy-2,2,6,6-tetramethylpiperidine to eye surface; halting growth, preventing surgery COLBY PHARMACEUTICAL COMPANY (US) 2013-02-26 US disclosed
US-7825134-B2 Amelioration of cataracts, macular degeneration and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2010-11-02 US disclosed
US-7825134-B2 Amelioration of cataracts, macular degeneration and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2010-11-02 US disclosed
US-7825134-B2 Amelioration of cataracts, macular degeneration and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2010-11-02 US disclosed
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases OTHERA HOLDING, INC. (US) 2008-11-06 US disclosed
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases OTHERA HOLDING, INC. (US) 2008-11-06 US disclosed
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases OTHERA HOLDING, INC. (US) 2008-11-06 US disclosed
US-7442711-B2 Amelioration of the development of cataracts and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2008-10-28 US disclosed
US-7442711-B2 Amelioration of the development of cataracts and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2008-10-28 US disclosed
US-7442711-B2 Amelioration of the development of cataracts and other ophthalmic diseases OTHERA HOLDING, INC. (US) 2008-10-28 US disclosed
US-20050131025-A1 Amelioration of cataracts, macular degeneration and other ophthalmic diseases COLBY PHARMACEUTICAL COMPANY 2005-06-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080274983-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases C3AR1, C1R, AKR1C3 TBXAS1 2070/4885ALDH1A1 756/4885EGLN3 1023/4885
US-20130131052-A1 Amelioration Of The Development Of Cataracts And Other Ophthalmic Diseases C3AR1, C1R, AKR1C3 TBXAS1 2070/4885ALDH1A1 756/4885EGLN3 1023/4885
US-20050131025-A1 Amelioration of cataracts, macular degeneration and other ophthalmic diseases C1R, CRYAB, C9 TBXAS1 2822/4885ALDH1A1 1080/4885EGLN3 1185/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.