SCHEMBL9748638

SCHEMBL9748638

CCOC(=O)c1ccccc1Cc1ccc2ccccc2c1O

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 2/20 0.56
CDC25A P30304 1/20 0.52
CDC25C P30307 1/20 0.52
TSHR P16473 1/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HCRTR1 O43613 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
SCHEMBL8773458 0.82 HCRTR1 (0.62) CDC25BCDC25ACDC25CTSHRKDM4E
SCHEMBL9749185 0.80 CDC25B (0.48) CDC25BCDC25ACDC25CTSHRKDM4E
SCHEMBL9749072 0.78 CDC25B (0.53) CDC25B
SCHEMBL9748755 0.78 CASP3 (0.51) TSHRALDH1A1
SCHEMBL277672 0.77 CDC25B (0.82) CDC25BCDC25ACDC25CTSHRKDM4E
SCHEMBL6010301 0.76
SCHEMBL29354413 0.76
SCHEMBL3807233 0.75 TSHR (0.57) CDC25BCDC25ACDC25CTSHRALDH1A1
SCHEMBL7670783 0.75 TSHR (0.71) CDC25BCDC25ACDC25CTSHRKDM4E
SCHEMBL578128 0.75 TSHR (0.77) CDC25BCDC25ACDC25CTSHRKDM4E

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
EP-0201071-B1 2-SUBSTITUTED-1-NAPHTHOLS AS 5-LIPOXYGENASE INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-03-04 EP disclosed
US-5026759-A Antiinflammatory agents respiratory system disorders DU PONT MERCK PHARMACEUTICAL (US) 1991-06-25 US disclosed
US-4985442-A ANTIINFLAMMATORY, LUNG DISEASES, PSORIASIS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-15 US disclosed
US-4985435-A TREATMENT OF INFLAMMATION, OBSTRUCTIVE LUNG DISEASES AND PSORIASIS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-15 US disclosed
US-4906636-A 2-Substituted-1-naphthols as 5-lipoxygenase inhibitors E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-06 US disclosed
US-4833164-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-05-23 US disclosed
EP-0201071-A2 2-Substituted-1-naphthols as 5-lipoxygenase inhibitors THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1986-11-12 EP disclosed