SCHEMBL9467111

SCHEMBL9467111

CSC1(C2CC(=O)C(C(=O)c3ccc(Cl)cc3Cl)C(=O)C2)CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CYP3A4 P08684 1/20 0.34
P2RX7 Q99572 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
HIF1A Q16665 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
SLC6A9 P48067 1/20 0.33
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
KDR P35968 1/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL8385690 0.81 LMNA (0.40) P2RX7ALDH1A1RAB9AMAPTGAA
SCHEMBL7344969 0.75 TSHR (0.50) SMN1; SMN2TSHRCASP1CYP3A4ALDH1A1
SCHEMBL10815118 0.75 SMN1; SMN2 (0.53) SMN1; SMN2TSHRCASP1SLC6A3CYP3A4
SCHEMBL7350816 0.71 SLC6A3 (0.44) SMN1; SMN2TSHRCASP1SLC6A3CYP3A4
SCHEMBL9874230 0.71 P2RX7 (0.49) SMN1; SMN2TSHRCASP1SLC6A3CYP3A4
SCHEMBL9814786 0.70 SMN1; SMN2 (0.47) SMN1; SMN2TSHRCASP1SLC6A3CYP3A4
SCHEMBL9807671 0.70 ALDH1A1 (0.45) SMN1; SMN2TSHRCASP1ALDH1A1NPC1
SCHEMBL9807692 0.69 MAPT (0.41) SMN1; SMN2TSHRCASP1CYP3A4ALDH1A1
SCHEMBL9468045 0.69 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9807668 0.67 TDP1 (0.42) CYP3A4ALDH1A1MAPK1NPC1RAB9A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365484-B1 SULFAMOYL PHENYL UREAS CIBA-GEIGY AG (CH) 1993-01-07 EP claimed
EP-0243313-B1 ACYL-CYCLOHEXANE DIONES AND THEIR OXIME ETHERS EXHIBITING A HERBICIDAL AND PLANT GROWTH ACTIVITY CIBA-GEIGY AG (CH) 1990-05-16 EP claimed
EP-0365484-A1 Sulfamoyl phenyl ureas CIBA-GEIGY AG (CH) 1990-04-25 EP claimed
US-4909835-A Containing a sulfur substitution in position 5 CIBA-GEIGY CORPORATION (US) 1990-03-20 US claimed
US-5215570-A Plant safening agents CIBA-GEIGY CORPORATION (US) 1993-06-01 US disclosed
EP-0365484-B1 SULFAMOYL PHENYL UREAS CIBA-GEIGY AG (CH) 1993-01-07 EP disclosed
US-5169988-A From unsaturated methyl ketone CIBA-GEIGY CORPORATION (US) 1992-12-08 US disclosed
US-5132462-A Sulfide, sulfonyl and sulfinyl compounds, agricultural use CIBA-GEIGY CORPORATION (US) 1992-07-21 US disclosed
US-5026899-A Acylcylohexanediones and the oxime ethers thereof with herbicidal and plant growth regulating properties CIBA-GEIGY CORPORATION (US) 1991-06-25 US disclosed
EP-0243313-B1 ACYL-CYCLOHEXANE DIONES AND THEIR OXIME ETHERS EXHIBITING A HERBICIDAL AND PLANT GROWTH ACTIVITY CIBA-GEIGY AG (CH) 1990-05-16 EP disclosed
EP-0365484-A1 Sulfamoyl phenyl ureas CIBA-GEIGY AG (CH) 1990-04-25 EP disclosed
US-4909835-A Containing a sulfur substitution in position 5 CIBA-GEIGY CORPORATION (US) 1990-03-20 US disclosed
EP-0243313-A1 Acyl-cyclohexane diones and their oxime ethers exhibiting a herbicidal and plant growth activity CIBA-GEIGY AG (CH) 1987-10-28 EP disclosed