SCHEMBL8874388

SCHEMBL8874388

COC(=O)c1ccc(NC(=O)Nc2ccc(OC)c(C34CC5CC(CC(C5)C3)C4)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.62
KMT2A Q03164 9/20 0.62
MAPT P10636 9/20 0.62
EPHX2 P34913 5/20 0.60
RARA P10276 2/20 0.53
RARB P10826 2/20 0.53
RARG P13631 2/20 0.53
NR1I2 O75469 1/20 0.53
LMNA P02545 1/20 0.53
PGR P06401 1/20 0.53
HSPD1 P10809 1/20 0.53
GOT1 P17174 1/20 0.53
GLRA1 P23415 1/20 0.53
BLM P54132 1/20 0.53
HSPE1 P61604 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 2/20 0.50
GAA P10253 2/20 0.50
HPGD P15428 1/20 0.50
NPSR1 Q6W5P4 1/20 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
SCHEMBL8874310 0.91 RARA (0.62) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL8696978 0.89 NPC1 (0.56) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL8695737 0.87 EPHX2 (0.52) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL566278 0.85 RARA (0.62) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL8839258 0.84 KMT2A (0.51) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL8695734 0.84 EPHX2 (0.49) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL25200687 0.83 RARB (0.69) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL8572221 0.81 RARA (0.55) MEN1KMT2AMAPTEPHX2RARA
SCHEMBL9453322 0.80 RARA (0.53) MEN1KMT2AMAPTRARARARB
SCHEMBL4936267 0.80 RARA (0.65) MEN1KMT2AEPHX2RARARARB

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