SCHEMBL11510752

SCHEMBL11510752

CNC(=O)Oc1ccccc1C1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.52
ACHE P22303 6/20 0.50
ALDH1A1 P00352 2/20 0.50
PTGS1 P23219 2/20 0.50
PGR P06401 1/20 0.50
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
BCHE P06276 3/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CHRM1 P11229 2/20 0.44
CHRM2 P08172 1/20 0.44
CHRM3 P20309 1/20 0.44
USP2 O75604 1/20 0.44
CYP1A2 P05177 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL11804134 0.98 PTGDR2 (0.55) PTGDR2ACHEALDH1A1PTGS1PGR
SCHEMBL27997079 0.84 PTGDR2 (0.56) PTGDR2ALDH1A1PTGS1MEN1KMT2A
SCHEMBL27703854 0.82 PTGDR2 (0.51) PTGDR2ALDH1A1PTGS1MEN1KMT2A
SCHEMBL1790688 0.82 PTGDR2 (0.56) PTGDR2ALDH1A1PTGS1HSD17B10MEN1
SCHEMBL1788879 0.81 PTGDR2 (0.56) PTGDR2ALDH1A1PTGS1HSD17B10MEN1
SCHEMBL1793106 0.81 PTGDR2 (0.59) PTGDR2ALDH1A1PTGS1HSD17B10MEN1
SCHEMBL28006501 0.80 PTGDR2 (0.62) PTGDR2ALDH1A1PTGS1MEN1KMT2A
SCHEMBL789204 0.80 PTGDR2 (0.62) PTGDR2PTGS1MEN1KMT2ACHRM1
SCHEMBL789205 0.79 PTGDR2 (0.65) PTGDR2ALDH1A1PTGS1MEN1KMT2A
SCHEMBL11710146 0.79 PTGDR2 (0.56) PTGDR2PTGS1MEN1KMT2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4172146-A Substituted phenyl derivatives CIBA-GEIGY CORPORATION (US) 1979-10-23 US disclosed
US-4153604-A INSECTICIDES CIBA-GEIGY CORPORATION (US) 1979-05-08 US disclosed
US-4069344-A INSECTICIDAL SUBSTITUTED PHENYL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-01-17 US disclosed
US-4067972-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1978-01-10 US disclosed
US-4017563-A INSECTICIDES, REDUCED TOXICITY TO MAMMALS CIBA-GEIGY AG (CH) 1977-04-12 US disclosed
US-4003964-A ACARICIDES, INSECTICIDES, NEMATOCIDES CIBA-GEIGY AG (CH) 1977-01-18 US disclosed
US-3998855-A INSECTICIDES CIBA-GEIGY CORPORATION (US) 1976-12-21 US disclosed
US-3991140-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1976-11-09 US disclosed
US-3975522-A Control of insects and acarids with N-phosphinylamidines CIBA-GEIGY CORPORATION (US) 1976-08-17 US disclosed
US-3969444-A PESTICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3969517-A INSECTICIDE, MITICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3969438-A PESTICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3966921-A NEMATOCIDES CIBA-GEIGY CORPORATION (US) 1976-06-29 US disclosed
US-3941829-A PESTICIDE CIBA-GEIGY CORPORATION (US) 1976-03-02 US disclosed
US-3933945-A O-ethyl-S-(n)propyl-S-diallylcarbmoylmethyldithiophosphate CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed