SCHEMBL6780926

SCHEMBL6780926

CC(=O)C1=C(O)C(=O)N(Cc2ccc(C)cc2)C1c1ccc(C)cc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
CCR1 P32246 4/20 0.62
KDM4E B2RXH2 5/20 0.59
ALDH1A1 P00352 3/20 0.59
PKM P14618 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CCR2 P41597 2/20 0.59
RXFP1 Q9HBX9 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
TSHR P16473 2/20 0.54
ALOX15 P16050 1/20 0.53

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
SCHEMBL6779535 0.94 MEN1 (0.80) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6776780 0.94 RXFP1 (0.66) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6785761 0.93 MEN1 (0.71) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6785309 0.93 MEN1 (0.79) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6781774 0.90 MEN1 (0.58) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6779215 0.87 RXFP1 (0.58) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6781053 0.82 MEN1 (0.79) MEN1KMT2AKDM4EALDH1A1PKM
SCHEMBL13313585 0.82 KDM4E (0.61) MEN1KMT2ACCR1KDM4EALDH1A1
SCHEMBL6779616 0.81 MEN1 (0.77) MEN1KMT2AKDM4EALDH1A1PKM
SCHEMBL6781607 0.81 MEN1 (1.00) MEN1KMT2AKDM4EALDH1A1PKM

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