SCHEMBL5046531

SCHEMBL5046531

Cc1ccc(-c2cc(C(=NO)c3ccc4c(C(=O)O)cccc4c3)cc(C(C)(C)C)c2OCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.38
PTPN1 P18031 1/20 0.38
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
DHODH Q02127 2/20 0.35
PTGER1 P34995 4/20 0.35
IDO1 P14902 1/20 0.34
SENP5 Q96HI0 1/20 0.34
SENP2 Q9HC62 1/20 0.34
SENP1 Q9P0U3 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
SCHEMBL5046526 1.00 P2RY14 (0.41) P2RY14MRGPRX4PTPN1RXRARXRB
SCHEMBL5049354 0.89 PTPN1 (0.38) MRGPRX4PTPN1DHODHIDO1
SCHEMBL5049355 0.89 PTPN1 (0.38) MRGPRX4PTPN1DHODHIDO1
SCHEMBL6419650 0.82 P2RY14 (0.41) P2RY14PTPN1RXRARXRBRXRG
SCHEMBL1406442 0.77 MAOB (0.45) P2RY14MRGPRX4PTPN1RXRARXRB
SCHEMBL1406772 0.76 LMNA (0.56) P2RY14MRGPRX4RXRARXRBRXRG
SCHEMBL1406702 0.72 TNFRSF1A (0.52) P2RY14MRGPRX4RXRARXRBRXRG
SCHEMBL1406700 0.72 TNFRSF1A (0.52) P2RY14MRGPRX4RXRARXRBRXRG
SCHEMBL1406410 0.68 MAOB (0.44) MRGPRX4RXRARXRBRXRG
SCHEMBL1406320 0.67 RXRA (0.41) MRGPRX4RXRARXRBRXRGPTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-06-16 US claimed
EP-1513793-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development, S.N.C. (FR) 2005-03-16 EP claimed
WO-2003101928-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2003-12-11 WO claimed
US-7468457-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-12-23 US disclosed
US-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-06-16 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-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof RARA, RARB, RARG P2RY14 2997/4885MRGPRX4 339/4885PTPN1 712/4885

“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.