SCHEMBL6575586

SCHEMBL6575586

Fc1ccc2sc(Cc3c[nH]c4ccccc34)nc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.58
AKR1B1 P15121 3/20 0.53
AKR1A1 P14550 2/20 0.53
MAPT P10636 3/20 0.50
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
AHR P35869 2/20 0.48
CYP3A4 P08684 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CDK4 P11802 1/20 0.44
CCND1 P24385 1/20 0.44
HTR1A P08908 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KRAS P01116 1/20 0.41

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
SCHEMBL6577863 0.90 GPR84 (0.58) GPR84AKR1B1AKR1A1MAPTMEN1
SCHEMBL6575533 0.85 AKR1B1 (0.55) GPR84AKR1B1AKR1A1MAPTMEN1
Acetic Acid SCHEMBL1598780 0.77 KMT2A (0.49) GPR84MAPTMEN1KMT2AAHR
SCHEMBL6229545 0.76 SMN1; SMN2 (0.56) AKR1B1AKR1A1MAPTMEN1KMT2A
SCHEMBL28984552 0.74 HDAC6 (0.55) AKR1B1AKR1A1MAPTMEN1KMT2A
SCHEMBL29007187 0.74 GPR84 (1.00) GPR84MAPTMEN1KMT2AAHR
SCHEMBL31744779 0.73 GPR84 (0.57) GPR84AKR1B1MAPTMEN1KMT2A
SCHEMBL6576335 0.72 AKR1A1 (0.53) GPR84AKR1B1AKR1A1MAPTMEN1
SCHEMBL28841871 0.70 GPR84 (0.73) GPR84MAPTMEN1KMT2AAHR
SCHEMBL28841901 0.70 GPR84 (0.73) GPR84MAPTMEN1KMT2AAHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1135124-B1 ANTIHYPERTRIGLYCERIDEMIC, ANTIHYPERGLYCEMIC, ANTI-ANGIOGENIC AND WOUND HEALING SUBSTITUDED INDOLEALKANOIC ACIDS INST FOR PHARM DISCOVERY INC (US) 2004-04-28 EP disclosed