SCHEMBL8439716

SCHEMBL8439716

COC(=O)c1cc2ccc(-c3ccc(C(=O)O)cc3)cc2cc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.69
KMT2A Q03164 3/20 0.69
THRB P10828 1/20 0.69
RECQL P46063 1/20 0.69
NR2E1 Q9Y466 1/20 0.69
RARB P10826 14/20 0.62
RARG P13631 14/20 0.62
RARA P10276 12/20 0.62
NR1I2 O75469 1/20 0.62
LMNA P02545 1/20 0.62
PGR P06401 1/20 0.62
HSPD1 P10809 1/20 0.62
GOT1 P17174 1/20 0.62
GLRA1 P23415 1/20 0.62
BLM P54132 1/20 0.62
HSPE1 P61604 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TP53 P04637 1/20 0.57

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
SCHEMBL8324536 0.89 MEN1 (0.56) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL5081241 0.88 RARG (0.72) MEN1KMT2ATHRBRECQLNR2E1
Hydrochloric Acid SCHEMBL9079139 0.87 RARG (0.71) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL8900666 0.84 RARB (0.78) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL7511260 0.84 MEN1 (0.61) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL8766397 0.83 RARB (0.66) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL7929993 0.83 MEN1 (0.51) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL8766438 0.83 RARB (0.62) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL25870579 0.83 MEN1 (0.76) MEN1KMT2ATHRBRECQLNR2E1
SCHEMBL7926577 0.82 MEN1 (0.75) MEN1KMT2ATHRBRECQLNR2E1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6001885-A INHIBITING VASCULAR ENDOTHELIAL GROWTH FACTOR (VEGF) EXPRESSION IN KERATINOCYTES BY ADMINISTERING AT LEAST ONE RETINOID; USEFUL FOR TREATING DISEASES RELATING TO VEGF OVEREXPRESSION, SUCH AS PSORIASIS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 1999-12-14 US claimed
US-6001885-A INHIBITING VASCULAR ENDOTHELIAL GROWTH FACTOR (VEGF) EXPRESSION IN KERATINOCYTES BY ADMINISTERING AT LEAST ONE RETINOID; USEFUL FOR TREATING DISEASES RELATING TO VEGF OVEREXPRESSION, SUCH AS PSORIASIS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 1999-12-14 US disclosed