SCHEMBL2909591

SCHEMBL2909591

CCCCOC(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc2cc(C(=O)O)ccc2c1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARA P10276 10/20 0.74
RARB P10826 10/20 0.74
RARG P13631 10/20 0.74
RXRA P19793 6/20 0.60
HNF4A P41235 1/20 0.60
CYP26A1 O43174 5/20 0.58
CYP26B1 Q9NR63 5/20 0.58
CYP3A4 P08684 2/20 0.55
RXRB P28702 3/20 0.54
RXRG P48443 2/20 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
SCHEMBL29462789 1.00 RARA (0.74) RARARARBRARGRXRAHNF4A
SCHEMBL9746771 0.83 RARA (0.51) RARARARBRARGRXRAHNF4A
SCHEMBL8950182 0.83 RARB (0.79) RARARARBRARGRXRACYP26A1
SCHEMBL6372648 0.81 RARB (1.00) RARARARBRARGRXRACYP26A1
SCHEMBL10541551 0.80 RARB (0.79) RARARARBRARGRXRACYP26A1
SCHEMBL5712092 0.80 RARB (0.79) RARARARBRARGRXRACYP26A1
SCHEMBL6147485 0.80 CYP26A1 (0.60) RARARARBRARGRXRAHNF4A
SCHEMBL6144036 0.80 CYP26A1 (0.60) RARARARBRARGRXRAHNF4A
SCHEMBL6144495 0.80 CYP26A1 (0.60) RARARARBRARGRXRAHNF4A
SCHEMBL9746659 0.79 RARA (0.59) RARARARBRARGRXRAHNF4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1255543-B1 USE OF RETINOID-TYPE COMPOUNDS AS ANTIBACTERIAL AGENTS AGAINST STAPHYLOCOCCUS AUREUS GALDERMA RES & DEV (FR) 2010-09-01 EP claimed
US-6858647-B2 Retinoid compounds suited for antibacterial applications GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2005-02-22 US claimed
US-20030055110-A1 Retinoid compounds suited for antibacterial applications GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-03-20 US claimed
EP-0220118-B1 BICYCLIC NAPHTHALENIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND VETERINARY MEDICINE AND COSMETICS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA (FR) 1992-01-02 EP claimed
US-20050208001-A1 PPAR receptor activator compounds for treating cutaneous disorders/afflictions SOCIETE L'OREAL, S.A. (FR) 2005-09-22 US disclosed
US-6858647-B2 Retinoid compounds suited for antibacterial applications GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2005-02-22 US disclosed
US-20030013734-A1 PPAR receptor activator compounds for treating cutaneous disorders/afflictions MAIGNAN JEAN (FR) 2003-01-16 US disclosed
US-20020049250-A1 PPAR receptor activator compounds for treating cutaneous disorders/afflictions SOCIETE L'OREAL, S.A. (FR) 2002-04-25 US disclosed
US-4826969-A SKIN AND EYE DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1989-05-02 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-20020049250-A1 PPAR receptor activator compounds for treating cutaneous disorders/afflictions PPARG, PPARA, PPARD RARA 12/4885RARB 20/4885RARG 28/4885
US-20030013734-A1 PPAR receptor activator compounds for treating cutaneous disorders/afflictions PPARG, PPARA, PPARD RARA 12/4885RARB 20/4885RARG 28/4885
US-20050208001-A1 PPAR receptor activator compounds for treating cutaneous disorders/afflictions PPARG, PPARA, PPARD RARA 12/4885RARB 23/4885RARG 28/4885

“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.