SCHEMBL5047191

SCHEMBL5047191

CCNC(=O)c1ccc(C#CC(O)c2cc(OCc3ccc(C)cc3)c3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
BRD4 O60885 6/20 0.37
ACACB O00763 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
NR1H4 Q96RI1 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
HNF4A P41235 1/20 0.34

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
SCHEMBL5050793 0.93 BRD4 (0.37) LMNABRD4ACACBMAPTMRGPRX4
SCHEMBL5044062 0.92 HDAC1 (0.41) LMNAALDH1A1MAPTMAPK1NR1H4
SCHEMBL5047199 0.91 BRD4 (0.35) LMNABRD4ACACBALDH1A1MAPT
SCHEMBL6409602 0.90 LMNA (0.34) LMNABRD4ALDH1A1MAPTMAPK1
SCHEMBL6411049 0.89 PARP10 (0.33) LMNABRD4ACACBALDH1A1MAPT
SCHEMBL5047094 0.89 CYP26A1 (0.44) MRGPRX4HNF4ACYP26A1CYP3A4CYP26B1
SCHEMBL6416228 0.89 HDAC1 (0.36) LMNABRD4ACACBALDH1A1MAPT
SCHEMBL5049705 0.88 PARP10 (0.44) ALDH1A1MAPTMAPK1HNF4ACYP26A1
SCHEMBL5043968 0.87 CYP3A4 (0.34) LMNAACACBALDH1A1MAPTHNF4A
SCHEMBL3067253 0.85 RXRA (0.36) ACACBALDH1A1HNF4ACYP26A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7326803-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-02-05 US claimed
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-07 US claimed
US-7326803-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-02-05 US disclosed
US-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-07 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 (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-20050148670-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof RARA, RARB, RARG LMNA 3890/4885BRD4 1941/4885ACACB 2255/4885

“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.