SCHEMBL7887100

SCHEMBL7887100

CCc1cc(Cl)ccc1C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 2/20 0.53
FLT4 P35916 2/20 0.53
KDR P35968 2/20 0.53
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.44
THRB P10828 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ABL1 P00519 1/20 0.43
JAK2 O60674 2/20 0.43
JAK1 P23458 1/20 0.43
TYK2 P29597 1/20 0.43
ADRA1D P25100 2/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43

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
Phenol SCHEMBL27731559 0.89 FLT1 (0.45) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL28252825 0.87 FLT1 (0.56) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL12505398 0.86 KDM4E (0.58) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL27701739 0.85 KDM4E (0.47) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL17350872 0.85 KDM4E (0.51) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL28837661 0.84 FLT1 (0.47) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL30423630 0.84 KDM4E (0.47) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL28045482 0.83 SIRT1 (0.46) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL10290473 0.82 HSD17B1 (0.56) FLT1FLT4KDRKDM4EALDH1A1
SCHEMBL1548854 0.82 SMN1; SMN2 (0.59) FLT1FLT4KDRKDM4EALDH1A1

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
EP-2200991-B1 ANTIBACTERIAL AGENTS BIOTA EUROPE LTD (GB) 2011-03-23 EP disclosed
WO-2010102003-A2 ALKYLSULFONYL-2,3-DIHYDROSPIRO[INDENE-1,4'-PIPERIDINE] ANALOGS AS GLYT1 INHIBITORS, METHODS FOR MAKING SAME, AND USE OF SAME IN TREATING PSYCHIATRIC DISORDERS VANDERBILT UNIVERSITY (US) 2010-09-10 WO disclosed