SCHEMBL7674060

SCHEMBL7674060

COc1ccc(Oc2ccc(Cl)cc2Cl)c(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 7/20 0.50
TTR P02766 3/20 0.50
SLC6A2 P23975 5/20 0.49
SLC6A3 Q01959 5/20 0.49
HPGD P15428 2/20 0.49
NR1I2 O75469 1/20 0.49
LMNA P02545 1/20 0.49
PGR P06401 1/20 0.49
HSP90AA1 P07900 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
MAPT P10636 1/20 0.49
HSPA5 P11021 1/20 0.49
CBR1 P16152 1/20 0.49
TBXA2R P21731 1/20 0.49
AGTR1 P30556 1/20 0.49
SLC6A4 P31645 5/20 0.46
OXTR P30559 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL7666779 0.80 HTR2A (0.44) HPGDMAPTSLC6A4ALDH1A1HTT
SCHEMBL7663772 0.80 S1PR4 (0.56) S1PR4TTRSLC6A2SLC6A3HPGD
SCHEMBL7186092 0.76 TTR (0.75) TTRSLC6A2SLC6A3HPGDNR1I2
SCHEMBL676629 0.75 TTR (0.73) TTRSLC6A2SLC6A3HPGDNR1I2
SCHEMBL7667376 0.75 L3MBTL1 (0.39) HPGDLMNAMAPTALDH1A1HTT
SCHEMBL7659916 0.75 TRPA1 (0.47) SLC6A2SLC6A4KCNH2
SCHEMBL7666314 0.75 L3MBTL1 (0.49) LMNAMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL12825409 0.74 LMNA (0.47) S1PR4TTRSLC6A2SLC6A3HPGD
SCHEMBL196490 0.72 TTR (0.62) TTRSLC6A2SLC6A3HPGDNR1I2
SCHEMBL29687129 0.72 TTR (0.62) TTRSLC6A2SLC6A3HPGDNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6458813-B1 2-CYCLOHEXYLOXY-5-(2-CHLOROPHENYLCARBONYLAMINO)PYRIDINE, FOR EXAMPLE; TREATING INFLAMMATION, PAIN, DIABETES, CANCER AMGEN INC. 2002-10-01 US disclosed
US-6333341-B1 TUMOR NECROSIS FACTOR, ANTIINFLAMMATORY AGENTS AND ANALGESICS AMGEN INC. 2001-12-25 US disclosed
US-6184237-B1 Substituted pyridine compounds and methods of use AMGEN INC. 2001-02-06 US disclosed