SCHEMBL7503293

SCHEMBL7503293

CC(=O)Nc1c(C(=O)c2ccncc2)[nH]c2cc(Cl)ccc12

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CHUK O15111 1/20 0.41
ALOX15 P16050 1/20 0.40
TP53 P04637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNMA1 Q12791 1/20 0.40
CCR9 P51686 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL7506093 0.90 KDM4E (0.47) KDM4EMEN1KMT2AALOX15TP53
SCHEMBL7503003 0.88 KDM4E (0.54) KDM4EMEN1KMT2ATP53ALDH1A1
SCHEMBL7504522 0.87 KDM4E (0.42) KDM4EMEN1KMT2ACHUKALOX15
SCHEMBL7506091 0.87 KDM4E (0.44) KDM4EMEN1KMT2AALOX15TP53
SCHEMBL7507568 0.86 KCNMA1 (0.44) KDM4EMEN1KMT2ACHUKALOX15
SCHEMBL7507628 0.86 ALOX15 (0.43) KDM4EMEN1KMT2AALOX15TP53
SCHEMBL7504271 0.84 KDM4E (0.47) KDM4EMEN1KMT2AALOX15TP53
SCHEMBL7512477 0.84 KDM4E (0.48) KDM4EMEN1KMT2AALOX15ALDH1A1
SCHEMBL7512768 0.83 KDM4E (0.43) KDM4EMEN1KMT2AALOX15TP53
SCHEMBL7507794 0.83 KDM4E (0.43) KDM4EMEN1KMT2AALOX15TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001934-B1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER (US) 2002-11-27 EP disclosed
US-6300363-B1 USEFUL IN THE TREATMENT OR ALLEVIATION OF INFLAMMATION AND OTHER INFLAMMATION ASSOCIATED DISORDERS IN MAMMALS PFIZER INC. 2001-10-09 US disclosed
EP-1001934-A1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 2000-05-24 EP disclosed
WO-1999005104-A1 INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 1999-02-04 WO disclosed