SCHEMBL6786235

SCHEMBL6786235

CC(=O)C1=C(O)C(=O)N(Cc2ccccc2)C1c1ccc(Cl)cc1Cl

nearest known ligand 0.78

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.78
KDM4E B2RXH2 5/20 0.71
HPGD P15428 2/20 0.71
NPSR1 Q6W5P4 3/20 0.63
POLB P06746 3/20 0.63
RXFP1 Q9HBX9 3/20 0.61
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ALOX15 P16050 3/20 0.58
APEX1 P27695 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
TP53 P04637 1/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
PPARG P37231 1/20 0.50
NCOR2 Q9Y618 1/20 0.50
TSHR P16473 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL6781053 0.83 MEN1 (0.79) ALDH1A1KDM4EHPGDNPSR1POLB
SCHEMBL6779502 0.79 MEN1 (0.82) ALDH1A1KDM4EHPGDNPSR1POLB
SCHEMBL6780434 0.79 RXFP1 (0.78) ALDH1A1KDM4EHPGDNPSR1POLB
SCHEMBL19420158 0.77 KDM4E (0.68) ALDH1A1KDM4EHPGDNPSR1RXFP1
SCHEMBL6785309 0.75 MEN1 (0.79) ALDH1A1KDM4EHPGDPOLBMEN1
SCHEMBL6781607 0.74 MEN1 (1.00) ALDH1A1KDM4EHPGDPOLBRXFP1
SCHEMBL6779616 0.74 MEN1 (0.77) ALDH1A1KDM4EHPGDPOLBRXFP1
SCHEMBL6779753 0.73 ALDH1A1 (1.00) ALDH1A1KDM4ENPSR1POLBRXFP1
SCHEMBL6780190 0.73 ALOX15 (0.63) ALDH1A1KDM4EHPGDNPSR1POLB
SCHEMBL6785761 0.73 MEN1 (0.71) ALDH1A1KDM4EHPGDPOLBRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727275-B2 ANTIINFLAMMATORY, ANTIALLERGEN, AND ANTIASTHMATIC AGENTS UCB, S.A./N.V. (BE) 2004-04-27 US claimed