SCHEMBL4623911

SCHEMBL4623911

C=CC(Cc1ccccc1)c1ccccc1C(=O)c1ccccc1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.42
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 2/20 0.41
CDC25B P30305 3/20 0.41
CAPN1 P07384 1/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP1A2 P05177 1/20 0.39
CDC25A P30304 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ATM Q13315 1/20 0.38
PRNP P04156 1/20 0.38
NR4A1 P22736 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
SCHEMBL4591556 0.87 CYP1A2 (0.38) ALDH1A1ALOX15CAPN1KMT2ACYP1A2
SCHEMBL7702215 0.77 FOLH1 (0.46) ALDH1A1ALOX15KMT2A
SCHEMBL467293 0.77 CYP1A2 (0.39) CAPN1KMT2ACYP1A2
SCHEMBL7197326 0.76 CAPN1 (0.44) ALDH1A1ALOX15CAPN1KMT2ACYP1A2
SCHEMBL3792769 0.76 AKR1C3 (0.44) AKR1C3ALDH1A1ALOX15CDC25BKMT2A
SCHEMBL9287878 0.74 POLB (0.44) CYP1A2
SCHEMBL6561251 0.72 ALDH1A1 (0.56) AKR1C3ALDH1A1ALOX15CDC25BKMT2A
SCHEMBL27637709 0.71 EPHX1 (0.36) ALDH1A1KMT2ACYP1A2
SCHEMBL4371723 0.71 ALDH1A1 (0.41) ALDH1A1ALOX15KMT2AHSD17B10
SCHEMBL11402284 0.71 ALDH1A1 (0.82) AKR1C3ALDH1A1ALOX15CDC25BKMT2A

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-0932652-B2 USE OF POLYMER DISPERSIONS AS BINDING AGENTS FOR SEALING COMPOUNDS AND COATING COMPOUNDS BASF SE (DE) 2008-04-23 EP disclosed
EP-0932652-B1 USE OF POLYMER DISPERSIONS AS BINDING AGENTS FOR SEALING COMPOUNDS AND COATING COMPOUNDS BASF AG (DE) 2002-12-18 EP disclosed
EP-1229086-A1 Utilisation of aqueous polymer dispersion compositions for the coating of metal objects BASF AKTIENGESELLSCHAFT (DE) 2002-08-07 EP disclosed