SCHEMBL5050776

SCHEMBL5050776

Cc1ccc(CN(C)c2cc(C(O)C=Cc3ccc(C(=O)O)c(O)c3)cc3c2C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARA P10276 3/20 0.43
RARB P10826 3/20 0.43
RARG P13631 3/20 0.43
HNF4A P41235 1/20 0.34
RXRA P19793 3/20 0.34
STAT3 P40763 7/20 0.33
PTPN1 P18031 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
HSP90AA1 P07900 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
STAT1 P42224 1/20 0.32
STAT5B P51692 1/20 0.32
MCL1 Q07820 2/20 0.32
BCL2L1 Q07817 1/20 0.32
PTPN2 P17706 1/20 0.32
PTPRS Q13332 1/20 0.32

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
SCHEMBL5050772 1.00 RARA (0.43) RARARARBRARGHNF4ARXRA
SCHEMBL5047083 0.93 RARB (0.42) RARARARBRARGRXRASTAT3
SCHEMBL5047269 0.93 RARA (0.42) RARARARBRARGRXRAPTPN1
SCHEMBL5047273 0.93 RARA (0.42) RARARARBRARGRXRAPTPN1
SCHEMBL5047077 0.93 RARB (0.42) RARARARBRARGRXRASTAT3
SCHEMBL5049616 0.88 RARB (0.57) RARARARBRARGHNF4ARXRA
SCHEMBL5049619 0.88 RARB (0.57) RARARARBRARGHNF4ARXRA
SCHEMBL5047065 0.85 HNF4A (0.37) RARARARBRARGHNF4ARXRA
SCHEMBL5047058 0.85 HNF4A (0.37) RARARARBRARGHNF4ARXRA
SCHEMBL5047355 0.83 RARA (0.44) RARARARBRARGHNF4ARXRA

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 RARA 1/4885RARB 2/4885RARG 3/4885

“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.