SCHEMBL5772661

SCHEMBL5772661

CCc1nc2cc(C(N)=O)c(Cl)cc2n1-c1c[c]ccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.36
HPGD P15428 3/20 0.36
AGTR1 P30556 1/20 0.33
AGTR2 P50052 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
CYP1A2 P05177 1/20 0.32
PDE10A Q9Y233 1/20 0.32
PIK3R2 O00459 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7100254 0.81 PDE10A (0.34) CYP1A2PDE10ANPSR1ESR1ESR2
SCHEMBL6425324 0.80 NR1H2 (0.35) HPGDAGTR1AGTR2CA12CA1
SCHEMBL27600064 0.79 PDE10A (0.32) HPGDCYP1A2PDE10AESR1ESR2
SCHEMBL27618366 0.79 DCTPP1 (0.40) CA12CA9SMN1; SMN2KMT2A
SCHEMBL3949489 0.79 KMT2A (0.38) PPARGHPGDAGTR1AGTR2NPSR1
SCHEMBL7097335 0.79 NR1H2 (0.37) CYP1A2PDE10AP2RX7
SCHEMBL27618382 0.78 PDE10A (0.38) CYP1A2PDE10AESR1ESR2
SCHEMBL1624207 0.78 JAK2 (0.39) PPARGAGTR1AGTR2ESR1ESR2
SCHEMBL1624257 0.78 PPARG (0.38) PPARGAGTR1AGTR2ESR1ESR2
SCHEMBL27618303 0.78 ALDH1A1 (0.44) HPGDCYP1A2PDE10ASMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1476448-A Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ������ҩ�����޹�˾ 2004-02-18 CN claimed
EP-1326864-B1 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMA (JP) 2006-03-15 EP disclosed
CN-1476448-A Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ������ҩ�����޹�˾ 2004-02-18 CN 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