SCHEMBL27364024

SCHEMBL27364024

NC(=O)c1ccccc1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.48
BCAT2 O15382 1/20 0.47
MAPT P10636 5/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 3/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 2/20 0.47
KCNN4 O15554 5/20 0.44
ALOX15 P16050 1/20 0.44
KMT2A Q03164 1/20 0.44
CTNNB1 P35222 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
PARP1 P09874 2/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 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
SCHEMBL28645883 0.85 ALDH1A1 (0.56) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9987053 0.82 BCAT2 (0.46) METAP2BCAT2MAPTALDH1A1KDM4E
SCHEMBL7895597 0.81 BCAT2 (0.44) METAP2BCAT2MAPTALDH1A1KDM4E
SCHEMBL5242160 0.81 MAPT (0.50) METAP2BCAT2MAPTALDH1A1KDM4E
SCHEMBL27811836 0.80 ALDH1A1 (0.45) MAPTALDH1A1KDM4EHPGDTSHR
SCHEMBL27752377 0.79 KCNN4 (0.45) METAP2BCAT2MAPTALDH1A1KDM4E
SCHEMBL1004509 0.78 ALDH1A1 (0.48) METAP2BCAT2MAPTALDH1A1KDM4E
SCHEMBL9986711 0.77 MAPT (0.42) METAP2BCAT2MAPTALDH1A1KDM4E
SCHEMBL31186401 0.76 ALDH1A1 (0.62) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8402762 0.76 ALDH1A1 (0.62) MAPTALDH1A1KDM4EHPGDHSD17B10

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
CN-1060778-C Cephalosporin derivatives HOFFMANN LA ROCHE (CH) 2001-01-17 CN disclosed