SCHEMBL8839062

SCHEMBL8839062

CC(C)Oc1ccc(C(=O)OCc2ccccc2)cc1C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.50
MAPT P10636 6/20 0.50
ALDH1A1 P00352 4/20 0.50
NPC1 O15118 4/20 0.50
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
KMT2A Q03164 3/20 0.49
TDP1 Q9NUW8 3/20 0.49
SLC6A2 P23975 1/20 0.49
SLC6A3 Q01959 1/20 0.49
HPGD P15428 1/20 0.47
RXRA P19793 2/20 0.44
RXRB P28702 2/20 0.44
RXRG P48443 2/20 0.44
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
GPBAR1 Q8TDU6 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.41
JMJD6 Q6NYC1 1/20 0.41

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
SCHEMBL8839285 0.92 RXRA (0.49) RAB9AMAPTALDH1A1NPC1LMNA
SCHEMBL8839153 0.85 KMT2A (0.41) RAB9AMAPTALDH1A1NPC1LMNA
Acetic Acid Methyl Ester SCHEMBL8839374 0.82 RAB9A (0.50) RAB9AMAPTALDH1A1NPC1LMNA
SCHEMBL8839077 0.81 LMNA (0.59) RAB9AMAPTALDH1A1NPC1LMNA
SCHEMBL8839093 0.79 RARB (0.52) RAB9AALDH1A1LMNAKMT2ARXRA
SCHEMBL11608103 0.78 KMT2A (0.58) RAB9AMAPTALDH1A1NPC1LMNA
SCHEMBL5081222 0.78 RARA (0.57) RAB9ANPC1SMN1; SMN2KMT2ARXRA
SCHEMBL8875455 0.77 LMNA (0.61) RAB9AMAPTALDH1A1NPC1LMNA
SCHEMBL29179301 0.77 KMT2A (0.61) RAB9AMAPTALDH1A1NPC1LMNA
SCHEMBL8994080 0.77 RXRA (0.51) RAB9AALDH1A1NPC1SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688817-A SKIN DISORDERS, ANTIINFLAMMATORY AGENTS, IMMUNOLOGY AND RHEUMATIC DISORDERS CENTRE INT'L. DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1997-11-18 US disclosed
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