SCHEMBL3540530

SCHEMBL3540530

O=C(O)c1cccc(-c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.66
RXRA P19793 2/20 0.66
RXRB P28702 2/20 0.66
TSHR P16473 1/20 0.62
CBS P35520 1/20 0.55
RPA1 P27694 1/20 0.55
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
ERN1 O75460 1/20 0.53
AHR P35869 1/20 0.52
MRGPRX4 Q96LA9 1/20 0.51
PLAU P00749 1/20 0.50
MAP4K4 O95819 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 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
SCHEMBL31312218 0.86 RXRA (0.62) KMORXRARXRBLMNAGAA
SCHEMBL23296152 0.84 RXRA (0.60) KMORXRARXRBLMNAGAA
SCHEMBL3208003 0.84 KMO (0.62) KMORXRARXRBLMNAGAA
SCHEMBL29577419 0.84 KMO (0.87) KMORXRARXRBLMNAGAA
SCHEMBL14683877 0.84 KMO (0.87) KMORXRARXRBLMNAGAA
SCHEMBL29904709 0.84 KMO (0.86) KMORXRARXRBTSHRLMNA
SCHEMBL30725957 0.84 KMO (0.86) KMORXRARXRBTSHRLMNA
SCHEMBL71238 0.84 KMO (0.86) KMORXRARXRBTSHRLMNA
SCHEMBL410752 0.84 RXRA (0.69) KMORXRARXRBERN1PLAU
SCHEMBL307574 0.83 RXRA (0.73) KMORXRARXRBTSHRLMNA

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 10 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-7727990-B2 Melanocortin receptor-specific piperazine and keto-piperazine compounds PALATIN TECHNOLOGIES, INC. (US) 2010-06-01 US disclosed
EP-1919479-A2 MELANOCORTIN RECEPTOR-SPECIFIC PIPERAZINE AND KETO-PIPERAZINE COMPOUNDS Palatin Technologies, Inc. (US) 2008-05-14 EP disclosed
WO-2007021991-A2 MELANOCORTIN RECEPTOR-SPECIFIC PIPERAZINE AND KETO-PIPERAZINE COMPOUNDS PALATIN TECHNOLOGIES, INC. (US) 2007-02-22 WO disclosed
US-20060287332-A1 Melanocortin Receptor-Specific Piperazine and Keto-Piperazine Compounds PALATIN TECHNOLOGIES, INC. (US) 2006-12-21 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-20210130328-A1 NOVEL COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE TMSB10, TMSB4X, TBCA KMO 4384/4885RXRA 2787/4885RXRB 2403/4885
US-20060287332-A1 Melanocortin Receptor-Specific Piperazine and Keto-Piperazine Compounds MC4R, MC5R, MC1R KMO 262/4885RXRA 223/4885RXRB 160/4885
US-11214564-B2 Compounds with thymine skeleton for use in medicine TMSB10, TMSB4X, TBCA KMO 4330/4885RXRA 2730/4885RXRB 2515/4885

“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.