SCHEMBL7016378

SCHEMBL7016378

Cc1cc(N)c(Nc2c[c]ccc2)nc1C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
MAPT P10636 3/20 0.33
TP53 P04637 2/20 0.33
RAPGEF4 Q8WZA2 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
SYK P43405 1/20 0.30

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
SCHEMBL7018790 0.86 ALDH1A1 (0.33) ALDH1A1RAPGEF4MEN1KMT2ACYP1A2
SCHEMBL6426194 0.82 ALDH1A1 (0.37) ALDH1A1KMT2ACYP1A2CYP2D6
SCHEMBL6384395 0.78 GSK3B (0.40) ALDH1A1MAPTMEN1KMT2ACYP1A2
SCHEMBL6386722 0.77 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ACYP1A2CYP2D6
SCHEMBL6386562 0.77 PIK3CA (0.39) TP53RAPGEF4SYK
SCHEMBL7014092 0.77 BCL6 (0.36) ALDH1A1
SCHEMBL7012728 0.75 EGFR (0.34) MAPTTP53MEN1KMT2A
SCHEMBL6386739 0.75 NR1I2 (0.38)
SCHEMBL7016784 0.75 ALDH1A1 (0.33) ALDH1A1MAPTTP53RAPGEF4MEN1
SCHEMBL7012481 0.74 EGFR (0.36) MEN1KMT2A

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-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
EP-1326606-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
WO-2002032422-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed