SCHEMBL2662991

SCHEMBL2662991

O=Cc1ccc(C(=O)NCCC(=O)O)o1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.63
LMNA P02545 1/20 0.63
ALDH1A1 P00352 5/20 0.46
HPGD P15428 5/20 0.44
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
CSF1R P07333 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GLA P06280 1/20 0.40
MMEL1 Q495T6 1/20 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
SCHEMBL13402907 0.84 POLB (0.61) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL13402898 0.84 ALDH1A1 (0.49) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL22289272 0.83 HPGD (0.49) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL2652440 0.80 HPGD (0.44) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL12999968 0.80 L3MBTL1 (0.71) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL3494577 0.80 KMT2A (0.49) L3MBTL1LMNAALDH1A1HPGDTSHR
SCHEMBL13402915 0.79 CYP2D6 (0.48) LMNAALDH1A1HPGDTSHRHDAC4
SCHEMBL22289268 0.78 HPGD (0.63) LMNAALDH1A1HPGDPOLBNPC1
SCHEMBL3496498 0.78 KMT2A (0.54) LMNAALDH1A1HPGDTSHRNPC1
SCHEMBL30954338 0.78 L3MBTL1 (0.71) L3MBTL1LMNAALDH1A1HPGDTSHR

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
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed