SCHEMBL11330451

SCHEMBL11330451

CCCc1sc2nc(C(=O)OCC)cn2c1C

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
CYP1A2 P05177 2/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
GABRA2 P47869 5/20 0.40
GABRB2 P47870 5/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2C19 P33261 1/20 0.39
ALOX5 P09917 1/20 0.38
MAPK1 P28482 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL11330713 0.92 GAA (0.46) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL11314005 0.89 GAA (0.50) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL11317904 0.87 GAA (0.47) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL11323481 0.83 GAA (0.52) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL11314056 0.78 L3MBTL1 (0.40) GAACYP1A2KDM4EHPGDNPC1
SCHEMBL11319174 0.73 MAPT (0.36) CYP1A2HPGDNPC1RAB9AMEN1
SCHEMBL20518797 0.72 MAPT (0.47) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL2922603 0.72 GAA (0.53) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL2930501 0.71 GAA (0.56) GAACYP1A2KDM4EALDH1A1POLB
SCHEMBL3601508 0.71 KDM4E (0.53) GAACYP1A2KDM4EALDH1A1POLB

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
US-4267339-A ANTIDIABETIC AGENTS PLANTEX LTD. (IL) 1981-05-12 US claimed
US-4137320-A Pharmaceutical compositions containing imidazo(2,1-b)thiazoles and process for reducing blood sugar levels therewith PLANTEX, LTD. (IL) 1979-01-30 US claimed
US-4267339-A ANTIDIABETIC AGENTS PLANTEX LTD. (IL) 1981-05-12 US disclosed
US-4137320-A Pharmaceutical compositions containing imidazo(2,1-b)thiazoles and process for reducing blood sugar levels therewith PLANTEX, LTD. (IL) 1979-01-30 US disclosed