SCHEMBL7139879

SCHEMBL7139879

O=Cc1ccc(-c2cccc(Cl)c2)cc1O.O=Cc1ccc(-c2cccc3ccccc23)cc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 2/20 0.47
▸ ACMSD Q8TDX5 1/20 0.47
▸ ALOX5 P09917 1/20 0.47
▸ CA12 O43570 2/20 0.43
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ SERPINE1 P05121 1/20 0.42
▸ ESR2 Q92731 1/20 0.40
▸ ERN1 O75460 6/20 0.39
▸ CYP1A2 P05177 3/20 0.39
▸ CYP1B1 Q16678 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CYP1A1 P04798 2/20 0.38
▸ BAD Q92934 1/20 0.37
▸ BACE1 P56817 1/20 0.37

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
SCHEMBL5340123 0.89 MCL1 (0.56) MCL1ACMSDCA12CA1CA2
SCHEMBL5736244 0.85 ALOX5 (0.62) ALOX5ESR2ERN1BACE1
SCHEMBL23238902 0.79 SERPINE1 (0.48) MCL1ACMSDALOX5CA12CA1
SCHEMBL8434860 0.79 SERPINE1 (0.50) MCL1ACMSDCA12CA1CA2
SCHEMBL5337591 0.78 MCL1 (0.60) MCL1ACMSDCA12CA1CA2
SCHEMBL30679633 0.78 TDP1 (0.43) CA12CA9ERN1CYP1A2CYP1B1
SCHEMBL26279852 0.78 CYP1A2 (0.47) MCL1ACMSDALOX5CA12CA1
SCHEMBL25681090 0.78 SERPINE1 (0.49) MCL1ACMSDCA12CA1CA2
SCHEMBL7170990 0.77 MCL1 (0.44) MCL1ACMSDCA12CA1CA2
SCHEMBL27254523 0.77 CYP1A2 (0.46) MCL1ACMSDALOX5CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1244446-A4 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORP (US) 2003-01-08 — — EP disclosed
EP-1244446-A1 THROMBOPOIETIN MIMETICS SmithKline Beecham Corporation (US) 2002-10-02 — — EP disclosed
WO-2001039773-A1 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2001-06-07 — — WO disclosed
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