SCHEMBL11510751

SCHEMBL11510751

CN(C(=O)O)c1ccccc1C1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.44
PKM P14618 1/20 0.42
LMNA P02545 1/20 0.40
ATM Q13315 1/20 0.39
SLC6A3 Q01959 2/20 0.38
HTR1D P28221 2/20 0.38
HTR1B P28222 2/20 0.38
SLC6A9 P48067 1/20 0.38
PTGS2 P35354 1/20 0.37
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
SLC18A3 Q16572 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL8451731 0.81 LMNA (0.47) PTGDR2PKMLMNASLC6A3HTR1D
SCHEMBL11686931 0.78 SLC6A3 (0.39) PKMLMNASLC6A3ALDH1A1
Hydrochloric Acid SCHEMBL28520193 0.77 HTR1D (0.42) PTGDR2HTR1DHTR1BPTGS2HTR1A
SCHEMBL5220798 0.77 HTR1D (0.42) PTGDR2HTR1DHTR1BPTGS2HTR1A
SCHEMBL4008865 0.77 SLC6A3 (0.35) PKMSLC6A3ALDH1A1KMT2ARAB9A
SCHEMBL11792582 0.76 FAAH (0.40) PKMLMNAATMALDH1A1MEN1
SCHEMBL11685520 0.75 KDM4E (0.37) PKMLMNAALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL28515535 0.75 HTR1D (0.41) PTGDR2HTR1DHTR1BPTGS2HTR1A
Hydrochloric Acid SCHEMBL28502715 0.75 HTR1D (0.41) PTGDR2HTR1DHTR1BPTGS2HTR1A
SCHEMBL27569420 0.75 LMNA (0.42) PTGDR2PKMLMNASLC6A3HTR1D

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-3969517-A INSECTICIDE, MITICIDE CIBA-GEIGY AG (CH) 1976-07-13 US disclosed
US-3969444-A PESTICIDE 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