SCHEMBL23296172

SCHEMBL23296172

COc1ccc(-c2cccc(C(=O)O)c2)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.59
PDE4B Q07343 1/20 0.59
PDE4C Q08493 1/20 0.59
PDE4D Q08499 1/20 0.59
KMO O15229 3/20 0.56
RXRA P19793 1/20 0.55
RXRB P28702 1/20 0.55
ERN1 O75460 1/20 0.54
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
TTR P02766 1/20 0.52
MRGPRX4 Q96LA9 2/20 0.52
ACLY P53396 2/20 0.52
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA7 P43166 1/20 0.51
TPMT P51580 1/20 0.51

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
SCHEMBL12171455 0.87 MYC (0.57) PDE4APDE4BPDE4CPDE4DKMO
SCHEMBL5151529 0.86 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DKMO
SCHEMBL28525131 0.83 NR4A2 (0.68) MRGPRX4RAB9ASMN1; SMN2
SCHEMBL308170 0.82 TPMT (0.69) LMNATTRMRGPRX4CA12CA1
SCHEMBL29524334 0.82 TPMT (0.69) LMNATTRMRGPRX4CA12CA1
SCHEMBL7611643 0.82 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DKMO
SCHEMBL5149280 0.82 LMNA (0.69) PDE4APDE4BPDE4CPDE4DKMO
SCHEMBL1812435 0.81 KMO (0.55) PDE4BPDE4DKMOTTRACLY
SCHEMBL3540530 0.80 KMO (0.66) KMORXRARXRBERN1LMNA
Hydrochloric Acid SCHEMBL306990 0.80 CA12 (0.67) LMNATTRMRGPRX4CA12CA1

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 6 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

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

For each of this compound's patents that has machine-readable text (2 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 PDE4A 3614/4885PDE4B 3693/4885PDE4C 3627/4885
US-11214564-B2 Compounds with thymine skeleton for use in medicine TMSB10, TMSB4X, TBCA PDE4A 3754/4885PDE4B 3829/4885PDE4C 3807/4885

“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.