SCHEMBL19746447

SCHEMBL19746447

Cc1cccc(-c2cccc(CC(=O)O)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.55
GRIN3B O60391 1/20 0.55
GRIN1 Q05586 1/20 0.55
GRIN2A Q12879 1/20 0.55
GRIN2B Q13224 1/20 0.55
GRIN2C Q14957 1/20 0.55
GRIN3A Q8TCU5 1/20 0.55
FFAR1 O14842 2/20 0.55
CTBP2 P56545 1/20 0.53
PTGS2 P35354 1/20 0.51
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
GLA P06280 1/20 0.50
KMT2A Q03164 1/20 0.50
AKR1B1 P15121 1/20 0.50
ENPP2 Q13822 1/20 0.50
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
ABCC4 O15439 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL504093 0.89 CTBP2 (0.64) FFAR1CTBP2MEN1TP53GLA
SCHEMBL29407189 0.89 CTBP2 (0.64) FFAR1CTBP2MEN1TP53GLA
SCHEMBL2532630 0.89 CTBP2 (0.64) FFAR1CTBP2MEN1TP53GLA
SCHEMBL23296113 0.88 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12087753 0.88 ABCC4 (0.67) FFAR1MEN1TP53GLAKMT2A
Ammonia Solution, Strong SCHEMBL27920742 0.87 CTBP2 (0.62) FFAR1CTBP2MEN1TP53GLA
SCHEMBL27949534 0.87 CTBP2 (0.62) FFAR1CTBP2MEN1TP53GLA
Hydrochloric Acid SCHEMBL2526973 0.87 CTBP2 (0.62) FFAR1CTBP2MEN1TP53GLA
Ammonia Solution, Strong SCHEMBL22042028 0.87 CTBP2 (0.62) FFAR1CTBP2MEN1TP53GLA
SCHEMBL28032595 0.87 LMNA (0.63) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11214564-B2 Compounds with thymine skeleton for use in medicine Technische Universität Dresden (DE) 2022-01-04 US disclosed
US-11214564-B2 Compounds with thymine skeleton for use in medicine Technische Universität Dresden (DE) 2022-01-04 US disclosed
EP-3819006-A1 COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-12 EP disclosed
EP-3819006-A1 COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-12 EP disclosed
US-20210130328-A1 NOVEL COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-06 US disclosed
US-20210130328-A1 NOVEL COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-06 US disclosed
US-20190161429-A1 Aromatic Esters and Polyesters, Production Without Esterification Catalyst, and Use EXXONMOBIL CHEMICAL PATENTS INC. 2019-05-30 US disclosed
EP-3475255-A1 AROMATIC ESTERS AND POLYESTERS, PRODUCTION WITHOUT ESTERIFICATION CATALYST, AND USE ExxonMobil Chemical Patents Inc. (US) 2019-05-01 EP disclosed
WO-2017222692-A1 AROMATIC ESTERS AND POLYESTERS, PRODUCTION WITHOUT ESTERIFICATION CATALYST, AND USE EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-12-28 WO 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-20210130328-A1 NOVEL COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE TMSB10, TMSB4X, TBCA GRIN2D 4738/4885GRIN3B 4342/4885GRIN1 3655/4885
US-20190161429-A1 Aromatic Esters and Polyesters, Production Without Esterification Catalyst, and Use PAH, ALKBH3, ALK GRIN2D 3894/4885GRIN3B 4571/4885GRIN1 4410/4885
US-11214564-B2 Compounds with thymine skeleton for use in medicine TMSB10, TMSB4X, TBCA GRIN2D 4739/4885GRIN3B 4359/4885GRIN1 3779/4885

“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.