SCHEMBL9628141

SCHEMBL9628141

CCC1=CC(=O)c2ccc(OC)cc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
NSD2 O96028 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
PTPN1 P18031 2/20 0.50
MPO P05164 1/20 0.49
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
GAPDH P04406 1/20 0.42
ALDH1A1 P00352 1/20 0.41
USP8 P40818 1/20 0.41
PPARG P37231 2/20 0.41
MAPT P10636 1/20 0.41
CHRNA7 P36544 1/20 0.41
METAP1 P53582 2/20 0.41
LCK P06239 1/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL30003193 0.94 MEN1 (0.54) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL9627655 0.94 MEN1 (0.54) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL11252510 0.78 GAPDH (0.50) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL5809726 0.78 IDO1 (0.62) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL12760698 0.78 PTPN1 (0.54) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL4294055 0.77 PTPN1 (0.53) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL10579406 0.77 PTPN1 (0.53) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL29406983 0.77 PTPN1 (0.53) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL13715099 0.75 GAPDH (0.49) KMT2AMEN1NSD2L3MBTL1PTPN1
SCHEMBL23111388 0.74 CA1 (0.57) KMT2AMEN1PTPN1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155132-A Nonsteroidal antiinflammatory agents; treating psoriasis SYNTEX (U.S.A.) INC. (US) 1992-10-13 US disclosed
US-5134161-A Enzyme inhibitors for skin disorders, antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-07-28 US disclosed
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
US-4786652-A TOPICAL ADMINISTRATION SYNTEX (U.S.A.) INC. (US) 1988-11-22 US disclosed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed