SCHEMBL9016833

SCHEMBL9016833

CS(=O)(=O)OCCc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.53
IDO1 P14902 2/20 0.47
ALOX5 P09917 1/20 0.47
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
MIF P14174 1/20 0.46
ACP3 P15309 1/20 0.45
DAO P14920 2/20 0.45
DPP4 P27487 1/20 0.44
NR3C1 P04150 1/20 0.44
MAOB P27338 3/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SIGMAR1 Q99720 1/20 0.41

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
SCHEMBL1579060 0.91 TAAR1 (0.50) TAAR1IDO1ALOX5HTR2AHTR2C
SCHEMBL10623823 0.85 CA1 (0.58) TAAR1IDO1ALOX5HTR2AHTR2C
SCHEMBL9572659 0.85 TAAR1 (0.53) TAAR1IDO1ALOX5HTR2AHTR2C
SCHEMBL8685464 0.84 IDO1 (0.58) TAAR1IDO1HTR2AHTR2CHTR2B
SCHEMBL5314366 0.84 IDO1 (0.51) TAAR1IDO1HTR2AHTR2CHTR2B
SCHEMBL16726983 0.84 IDO1 (0.42) IDO1DAOKDM4EMEN1KMT2A
SCHEMBL7724359 0.81 FFAR1 (0.49) TAAR1IDO1ALOX5FFAR4MEN1
SCHEMBL1170170 0.81 KMT2A (0.51) TAAR1IDO1MIFDAOMAOB
SCHEMBL858115 0.80 TAAR1 (0.49) TAAR1IDO1ALOX5DAONR3C1
SCHEMBL24615983 0.79 TAAR1 (0.61) TAAR1IDO1ALOX5HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150126516-A1 PIPERIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-05-07 US disclosed
EP-2845851-A1 PIPERIDINE COMPOUND AND PEST-CONTROL USE THEREFORE Sumitomo Chemical Company Limited (JP) 2015-03-11 EP disclosed
CN-104302623-A Piperidine compound and pest-control use therefore SUMITOMO CHEMICAL CO 2015-01-21 CN disclosed
EP-0714894-A1 3-(1,2,3,6-tetrahydro-(1-alkylenearyl)-4-pyridinyl)- and 3-(1-alkylenearyl)-4-piperidinyl-1h-indoles: new 5-HT1f agonists ELI LILLY AND COMPANY (US) 1996-06-05 EP disclosed
US-5521197-A ANALGESICS USING SEROTONIN ANTAGONIST ELI LILLY AND COMPANY (US) 1996-05-28 US disclosed
EP-0144729-B1 11-Substituted 5H,11H-pyrrolo[2,1-c][1,4]benzoxazepines, a process for their preparation and their use in medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-11-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150126516-A1 PIPERIDINE COMPOUND AND ITS USE IN PEST CONTROL ZYX, CXXC5, CNBP TAAR1 110/4885IDO1 1232/4885ALOX5 1911/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.