SCHEMBL39298

SCHEMBL39298

CCC(C)OC(=O)c1ccc(O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.67
CA1 P00915 3/20 0.67
CA2 P00918 3/20 0.67
CA7 P43166 3/20 0.67
CA9 Q16790 3/20 0.67
CA14 Q9ULX7 3/20 0.67
ALDH1A1 P00352 2/20 0.59
ESR1 P03372 5/20 0.56
ESR2 Q92731 2/20 0.56
TSHR P16473 3/20 0.53
CHRM1 P11229 2/20 0.53
SLC6A2 P23975 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
KDR P35968 1/20 0.53
LMNA P02545 3/20 0.50
MAPK1 P28482 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C19 P33261 2/20 0.50
NR1H2 P55055 1/20 0.50

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
SCHEMBL9724886 1.00 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL9437191 0.95 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL9437187 0.95 CA12 (0.61) CA12CA1CA2CA7CA9
Phenol SCHEMBL3274652 0.93 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL1965809 0.92 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL4736415 0.87 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL6388164 0.86 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL6388169 0.86 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL8198278 0.86 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL8970835 0.86 CA12 (0.62) CA12CA1CA2CA7CA9

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 536 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3490525-A1 SKIN CARE PRODUCTS AND USES THEREOF Wang, Jonas (US) 2019-06-05 EP claimed
US-20190159991-A1 SKIN CARE PRODUCTS AND USES THEREOF WANG, JONAS 2019-05-30 US claimed
EP-2768909-B1 INK FORMULATION AND MANUFACTURE THEREOF EndoChoice (US) 2018-08-01 EP claimed
WO-2018022561-A1 SKIN CARE PRODUCTS AND USES THEREOF WANG JONAS (US) 2018-02-01 WO claimed
US-20170049735-A1 BROMFENAC BIOAVAILABILITY BAUSCH & LOMB PHARMA HOLDINGS CORP. (US) 2017-02-23 US claimed
US-9034087-B2 Ink formulation and manufacture thereof ENDOCHOICE, INC. (US) 2015-05-19 US claimed
EP-2768909-A1 INK FORMULATION AND MANUFACTURE THEREOF Endochoice (US) 2014-08-27 EP claimed
EP-2765988-A1 OCULAR COMPOSITION CONTAINING BROMFENAC WITH INCREASED BIOAVAILABILITY Bausch & Lomb Incorporated (US) 2014-08-20 EP claimed
US-20140182480-A1 Ink Formulation and Manufacture Thereof ENDOCHOICE INC. (US) 2014-07-03 US claimed
US-8709142-B2 Ink formulation and manufacture thereof ENDOCHOICE, INC. (US) 2014-04-29 US claimed
EP-1076567-A4 COMPOSITIONS AND METHOD FOR IMMUNIZING POULTRY MKB INVEST LTD PARTNERSHIP (US) 2001-12-12 EP claimed
EP-1076567-A1 COMPOSITIONS AND METHOD FOR IMMUNIZING POULTRY Mkb Investments Limited Partnership (US) 2001-02-21 EP claimed
WO-1999059626-A1 COMPOSITIONS AND METHOD FOR IMMUNIZING POULTRY MKB INVESTMENTS LIMITED PARTNERSHIP (US) 1999-11-25 WO claimed
EP-0689418-B1 DEODORANT ACTIVE-SUBSTANCE COMBINATIONS MADE FROM WOOL-GREASE ACIDS AND PARTIAL GLYCERIDES SOLVAY ALKALI GMBH (DE) 1998-09-30 EP claimed
EP-0226671-B1 TITANIUM DIOXIDE SUSPENSION FOR USE IN FILM COATING CROMPTON & KNOWLES CORPORATION (US) 1991-04-03 EP claimed
US-4833023-A CONTAINING SOILD PLASTICIZER MITSUBISHI PAPER MILLS, LTD. (JP) 1989-05-23 US claimed
US-4695452-A Cosmetic stick GANNIS PETER M 1987-09-22 US claimed
EP-0226671-A1 Titanium dioxide suspension for use in film coating CROMPTON & KNOWLES CORPORATION (US) 1987-07-01 EP claimed
US-4642663-A 6-tetrahydrofurfurylaminofluoran compound useful as a color former on an heat sensitive recording sheet HODOGAYA CHEMICAL CO., LTD. (JP) 1987-02-10 US claimed
US-4357258-A Stable emulsions of p-hydroxybenzoic acid esters and method of preparation MALLINCKRODT, INC. (US) 1982-11-02 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20190159991-A1 SKIN CARE PRODUCTS AND USES THEREOF CUTA, PROC, GLA CA12 4229/4885CA1 4691/4885CA2 2261/4885

“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.