SCHEMBL8867748

SCHEMBL8867748

O=C(NCCl)Nc1cccc(/C=C/CO)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 1/20 0.45
KDR P35968 1/20 0.45
MAOA P21397 3/20 0.44
MAOB P27338 3/20 0.44
RHOA P61586 1/20 0.43
PKM P14618 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MTOR P42345 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
SCHEMBL8867734 0.89 MAOA (0.44) MAOAMAOBPKMMEN1KMT2A
SCHEMBL8867739 0.89 MAOA (0.44) MAOAMAOBPKMMEN1KMT2A
SCHEMBL8866966 0.86 MAPT (0.46) FGFR3KDRMAOAMAOBRHOA
SCHEMBL8867294 0.84 MAOB (0.53) MAOAMAOBRHOAPKMMEN1
SCHEMBL8868116 0.84 MAPT (0.60) FGFR3KDRPKMMEN1KMT2A
SCHEMBL8867060 0.84 FGFR3 (0.44) FGFR3KDRMAOAMAOBRHOA
SCHEMBL8867685 0.83 MAOB (0.46) FGFR3KDRMAOAMAOBRHOA
SCHEMBL8867211 0.82 EPHX1 (0.56) PKMMAPTALDH1A1HTT
SCHEMBL8867195 0.82 CA12 (0.56) FGFR3KDRMAOAMAOBRHOA
SCHEMBL8868715 0.80 CA12 (0.51) MAOAMAOBRHOAMEN1KMT2A

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-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed