SCHEMBL4577375

SCHEMBL4577375

CCN(CC)c1ccc(-c2cc(-c3ccc(OCCCO[Si](C)(C)C(C)(C)C)cc3)ccc2C(=O)O)cc1C

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 15/20 0.51
RARG P13631 12/20 0.51
RARA P10276 11/20 0.51
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MCL1 Q07820 1/20 0.35
DHODH Q02127 1/20 0.35
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 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
SCHEMBL382090 0.83 RARA (0.48) RARBRARGRARANPC1RAB9A
SCHEMBL382380 0.79 RARB (0.42) RARBRARGRARANPC1RAB9A
SCHEMBL382740 0.79 RARG (0.61) RARBRARGRARA
SCHEMBL4576451 0.76 RARG (0.69) RARBRARGRARADHODH
SCHEMBL382994 0.76 RARA (0.51) RARBRARGRARAKDM4ENPC1
SCHEMBL382393 0.72 RARG (0.55) RARBRARGRARAKDM4EALDH1A1
SCHEMBL382549 0.71 RARG (0.60) RARBRARGRARA
SCHEMBL3439183 0.71 RARG (0.63) RARBRARGRARA
SCHEMBL382163 0.70 HRH3 (0.43) NPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL5855140 0.69 RARB (0.64) RARBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080015246-A1 Novel ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-17 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-20080015246-A1 Novel ligands that modulate RAR receptors and pharmaceutical/cosmetic compositions comprised thereof RARB, RARA, RARG RARB 1/4885RARG 3/4885RARA 2/4885

“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.