SCHEMBL11554180

SCHEMBL11554180

O=C(O)C(CO)c1ccco1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
POLB P06746 2/20 0.57
PTPN1 P18031 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
PKM P14618 2/20 0.57
PTPN7 P35236 1/20 0.57
BLM P54132 1/20 0.57
ESR2 Q92731 1/20 0.57
CYP2C19 P33261 2/20 0.46
MIF P14174 1/20 0.45
ALOX5 P09917 1/20 0.43
MEN1 O00255 3/20 0.43
AGTR1 P30556 1/20 0.43
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 2/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GLA P06280 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
SCHEMBL27813689 0.86 KMT2A (0.48) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL8995856 0.82 KMT2A (0.55) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL11392151 0.82 MIF (0.56) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL10963512 0.79 KMT2A (0.52) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL28114623 0.79 KMT2A (0.52) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL10708793 0.77 L3MBTL1 (0.48) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL901144 0.76 KMT2A (0.50) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL11847308 0.74 KMT2A (0.46) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL4753938 0.74 KMT2A (0.65) KMT2APOLBPTPN1L3MBTL1PKM
SCHEMBL9318301 0.74 KMT2A (0.65) KMT2APOLBPTPN1L3MBTL1PKM

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
JP-54036256-A None JP disclosed
JP-S5436256-A 2-(2-FURYL)-3-HYDROXYPROPYONIC ACIDS AND THEIR PREPARATION NIPPON KAYAKU CO LTD 1979-03-16 JP disclosed