SCHEMBL7858147

SCHEMBL7858147

N[C@H](CCc1ccccc1)[C@@H](O)c1nc2cc(Cl)ccc2o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 4/20 0.44
CASP3 P42574 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
SENP6 Q9GZR1 2/20 0.44
METAP2 P50579 2/20 0.42
CYP1A2 P05177 2/20 0.42
MAPT P10636 2/20 0.42
MAPK1 P28482 2/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
KDM4E B2RXH2 5/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 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
SCHEMBL7736136 1.00 XDH (0.46) XDHLMNAKMT2ASMN1; SMN2CASP3
SCHEMBL7732448 0.87 METAP2 (0.38) XDHLMNAKMT2ASMN1; SMN2METAP2
SCHEMBL7732480 0.86 HSD17B10 (0.41) LMNASMN1; SMN2METAP2CYP1A2MAPT
SCHEMBL7561710 0.85 FAAH (0.42) XDHLMNASMN1; SMN2METAP2CYP1A2
SCHEMBL7732346 0.85 FAAH (0.42) XDHLMNASMN1; SMN2METAP2CYP1A2
SCHEMBL5431040 0.85 FAAH (0.42) XDHLMNASMN1; SMN2METAP2CYP1A2
SCHEMBL6462278 0.85 FAAH (0.42) XDHLMNASMN1; SMN2METAP2CYP1A2
SCHEMBL7730784 0.83 METAP2 (0.40) SMN1; SMN2METAP2CYP1A2MAPTKDM4E
SCHEMBL7730692 0.83 CTSL (0.42) XDHSMN1; SMN2METAP2CYP1A2MAPT
SCHEMBL7729637 0.82 METAP2 (0.41) LMNASMN1; SMN2METAP2CYP1A2MAPT

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
US-6204279-B1 SECONDARY AMIDE CONTAINING BENZOXAZOLE DERIVATIVES MICROCIDE PHARMACEUTICALS, INC. 2001-03-20 US disclosed