SCHEMBL4965729

SCHEMBL4965729

CC1(C)CCC(C)(C)c2cc(-c3ccccc3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RARB P10826 16/20 0.69
RARA P10276 15/20 0.69
RARG P13631 15/20 0.69
RXRA P19793 5/20 0.58
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
ABCB1 P08183 1/20 0.44
ABCC1 P33527 1/20 0.44

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
SCHEMBL25637844 0.90 RARB (0.71) RARBRARARARGRXRARXRB
SCHEMBL25791078 0.90 RARB (0.62) RARBRARARARGRXRARXRB
SCHEMBL25793227 0.90 RARB (0.62) RARBRARARARGRXRARXRB
SCHEMBL25491121 0.90 RARA (0.58) RARBRARARARGRXRAABCB1
SCHEMBL24794217 0.90 RARA (0.58) RARBRARARARGRXRARXRB
SCHEMBL24794218 0.90 RARA (0.58) RARBRARARARGRXRARXRB
SCHEMBL25791077 0.90 RARB (0.62) RARBRARARARGRXRARXRB
SCHEMBL26304510 0.88 RARA (0.57) RARBRARARARGRXRARXRB
SCHEMBL26304678 0.88 RARA (0.57) RARBRARARARGRXRARXRB
SCHEMBL26304511 0.88 RARA (0.57) RARBRARARARGRXRARXRB

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
CN-114957152-A Synthetic method of benzoxazole compound 湖南第一师范学院 2022-08-30 CN disclosed
WO-2021107681-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-06-03 WO disclosed
EP-1933827-A2 COMPOSITION COMPRISING AT LEAST ONE NAPHTHOIC ACID DERIVATIVE AND AT LEAST ONE COMPOUND OF POLYURETHANE POLYMER TYPE OR DERIVATIVES THEREOF, PREPARATION PROCESSES THEREFOR AND USES THEREOF Galderma Research & Development, S.N.C. (FR) 2008-06-25 EP disclosed
US-7259187-B2 Tropolone derivatives RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2007-08-21 US disclosed
WO-2007031883-A2 COMPOSITION COMPRISING AT LEAST ONE NAPHTHOIC ACID DERIVATIVE AND AT LEAST ONE COMPOUND OF POLYURETHANE POLYMER TYPE OR DERIVATIVES THEREOF, PREPARATION PROCESSES THEREFOR AND USES THEREOF GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-03-22 WO disclosed