SCHEMBL8875455

SCHEMBL8875455

CC(C)(C)c1cc(C(=O)OCc2ccc(C(=O)OCc3ccccc3)cc2)cc(C(C)(C)C)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
KMT2A Q03164 3/20 0.58
TDP1 Q9NUW8 3/20 0.58
SLC6A2 P23975 1/20 0.58
SLC6A3 Q01959 1/20 0.58
MAPT P10636 5/20 0.55
ALDH1A1 P00352 2/20 0.55
HPGD P15428 1/20 0.55
MEN1 O00255 1/20 0.54
RAB9A P51151 4/20 0.50
GAA P10253 1/20 0.50
NPC1 O15118 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
HSP90AA1 P07900 1/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47

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
SCHEMBL11608103 0.96 KMT2A (0.58) LMNAKMT2ATDP1SLC6A2SLC6A3
SCHEMBL9364258 0.94 KMT2A (0.54) LMNAKMT2ATDP1SLC6A2SLC6A3
Benzoic Acid SCHEMBL9364247 0.92 RXRA (0.55) LMNAKMT2ATDP1SLC6A2SLC6A3
SCHEMBL5080279 0.90 RXRA (0.52) LMNAKMT2ATDP1SLC6A2SLC6A3
SCHEMBL11610430 0.88 LMNA (0.50) LMNAKMT2ATDP1SLC6A2SLC6A3
Butylated Hydroxytoluene SCHEMBL16652654 0.88 TDP1 (0.60) LMNAKMT2ATDP1SLC6A2SLC6A3
SCHEMBL12003778 0.87 KMT2A (0.58) LMNAKMT2ATDP1SLC6A2SLC6A3
SCHEMBL11607589 0.86 MEN1 (0.49) LMNAKMT2AMAPTALDH1A1HPGD
SCHEMBL11768900 0.86 KMT2A (0.54) LMNAKMT2ATDP1SLC6A2SLC6A3
SCHEMBL8839077 0.85 LMNA (0.59) LMNAKMT2ATDP1SLC6A2SLC6A3

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-5668156-A TREATMENT OF WARTS, ACNE, PSORIASIS, CORNEOPATHIES, KETONES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1997-09-16 US disclosed
US-5597839-A TREATMENT OF SKIN DISORDERS OR ANTIINFLAMMATORY AGENTS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1997-01-28 US disclosed
US-5567721-A AROMATIC UREA COMPOUND FOR SKIN DISORDER, RHEUMATIC DISEASE, RESPIRATORY DISORDER AND EYE DISORDER CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 1996-10-22 US disclosed
US-5439925-A Skin disorders, rheumatic diseases CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1995-08-08 US disclosed
US-5387594-A Administering for topical and systemic treatment of CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1995-02-07 US disclosed