SCHEMBL9822510

SCHEMBL9822510

CCS(=O)(=O)c1ccc2cc(C(O)c3ccc4c(c3)C(C)(C)CCC4(C)C)ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.61
RARG P13631 11/20 0.61
RARA P10276 10/20 0.61
RXRA P19793 3/20 0.53
CYP26A1 O43174 6/20 0.44
CYP26B1 Q9NR63 5/20 0.44
CYP3A4 P08684 2/20 0.44
RXRB P28702 2/20 0.41
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
SPPL2A Q8TCT8 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
RXRG P48443 1/20 0.37

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
SCHEMBL9822546 0.79 RXRA (0.64) RARBRARGRARARXRACYP26A1
SCHEMBL9822486 0.79 RARB (0.66) RARBRARGRARARXRACYP26A1
SCHEMBL9822401 0.78 RXRA (0.63) RARBRARGRARARXRACYP26A1
SCHEMBL9822469 0.78 RXRA (0.56) RARBRARGRARARXRACYP26A1
SCHEMBL9822527 0.77 CYP26B1 (0.44) RARBRARGRARARXRACYP26A1
SCHEMBL9746456 0.77 RARA (0.63) RARBRARGRARARXRACYP26A1
SCHEMBL9746853 0.76 RARB (0.65) RARBRARGRARARXRACYP26A1
SCHEMBL6372648 0.76 RARB (1.00) RARBRARGRARARXRACYP26A1
SCHEMBL8457553 0.76 RARB (0.65) RARBRARGRARARXRACYP26A1
SCHEMBL9747949 0.75 RARB (0.71) RARBRARGRARARXRACYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0297995-B1 POLYCYCLIC AROMATIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND ANIMAL MEDICINE AND IN COSMETICS L'OREAL (FR) 1991-03-06 EP claimed
US-4980509-A Aromatic polycyclic derivatives, their process of preparation and their use in human and veterinary medicine and in cosmetics SOCIETE ANONYME DITE: L'OREAL (FR) 1990-12-25 US claimed
US-4980509-A Aromatic polycyclic derivatives, their process of preparation and their use in human and veterinary medicine and in cosmetics SOCIETE ANONYME DITE: L'OREAL (FR) 1990-12-25 US disclosed