SCHEMBL7016784

SCHEMBL7016784

Cc1cc(Cl)nc(Nc2c[c]ccc2)c1N

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
BCL6 P41182 1/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
CCR2 P41597 1/20 0.31
CCR5 P51681 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NOD1 Q9Y239 1/20 0.30
NR1I2 O75469 1/20 0.30
AHR P35869 1/20 0.30
SRC P12931 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
NFKB1 P19838 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
SCHEMBL6386722 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ACYP1A2CYP2D6
SCHEMBL6386816 0.79 MAPT (0.39) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7018790 0.78 ALDH1A1 (0.33) ALDH1A1MEN1KMT2ABCL6RAPGEF4
SCHEMBL7012728 0.76 EGFR (0.34) MEN1KMT2ATP53MAPTNR1I2
SCHEMBL7016378 0.75 ALDH1A1 (0.34) ALDH1A1MEN1KMT2ATP53MAPT
SCHEMBL6426194 0.74 ALDH1A1 (0.37) ALDH1A1KMT2ABCL6RAB9ACYP1A2
SCHEMBL6386739 0.73 NR1I2 (0.38) NR1I2AHR
SCHEMBL7014092 0.72 BCL6 (0.36) ALDH1A1BCL6
SCHEMBL6384780 0.70 CYP1A2 (0.38) MEN1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL6386562 0.69 PIK3CA (0.39) TP53SMN1; SMN2RAPGEF4

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