SCHEMBL9511796

SCHEMBL9511796

CCOC(=O)OC1=NC(=O)N=C1c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
ALDH1A1 P00352 5/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
LMNA P02545 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 2/20 0.40
TRPM8 Q7Z2W7 2/20 0.40
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
MAPK1 P28482 2/20 0.40
USP2 O75604 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ATM Q13315 1/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL9456913 0.77 ALDH1A1 (0.49) ALDH1A1MAPTSMN1; SMN2LMNANPC1
SCHEMBL10438825 0.75 ALDH1A1 (0.43) ALOX5ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL6976915 0.70 NPC1 (0.51) ALOX5ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL37520 0.69 MAPT (0.56) ALOX5ALDH1A1MAPTNPC1RAB9A
SCHEMBL7759462 0.69 ALOX5 (0.44) ALOX5ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL1839147 0.68 L3MBTL1 (0.49) ALOX5ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL17697666 0.68 LMNA (0.47) ALOX5ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL4633787 0.68 MAPT (0.44) ALDH1A1MAPTSMN1; SMN2LMNANPC1
SCHEMBL8195881 0.67 ALDH1A1 (0.40) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL8516383 0.67 TSHR (0.52) ALOX5ALDH1A1MAPTLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0380985-B1 Esters of 4-aryl-2-halogen imidazol-5-carbonic acid, their preparation and use BASF AG (DE) 1993-12-08 EP disclosed
EP-0380985-A2 Esters of 4-aryl-2-halogen imidazol-5-carbonic acid, their preparation and use BASF Aktiengesellschaft (DE) 1990-08-08 EP disclosed