SCHEMBL73284

SCHEMBL73284

CC(C)(C)C(=O)Nc1ccc(F)cc1C1(O)CCN(Cc2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPY2R P49146 3/20 0.48
EEF2K O00418 1/20 0.47
OPRL1 P41146 3/20 0.45
CYP2D6 P10635 2/20 0.44
MAPK1 P28482 1/20 0.44
POLB P06746 1/20 0.44
CHRM4 P08173 2/20 0.43
SIGMAR1 Q99720 3/20 0.43
CCR8 P51685 1/20 0.42
CCR3 P51677 1/20 0.42
CACNA1G O43497 1/20 0.42
ALDH1A1 P00352 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
SCHEMBL73170 0.89 CCR3 (0.51) KMT2ANPY2ROPRL1CYP2D6POLB
SCHEMBL83703 0.88 SIGMAR1 (0.49) SIGMAR1CCR3CACNA1G
SCHEMBL6967833 0.78 OPRL1 (0.56) MEN1KMT2AOPRL1CYP2D6MAPK1
SCHEMBL745670 0.76 OPRL1 (0.51) MEN1KMT2AOPRL1CYP2D6MAPK1
SCHEMBL6649554 0.76 OPRL1 (0.56) MEN1KMT2AOPRL1CYP2D6MAPK1
SCHEMBL11154987 0.75 CCR3 (0.52) KMT2AOPRL1CYP2D6POLBCHRM4
SCHEMBL6178711 0.75 CCR8 (0.54) MEN1KMT2AOPRL1MAPK1POLB
SCHEMBL74825 0.75 CCNT1 (0.49) MEN1KMT2ANPY2REEF2KMAPK1
SCHEMBL11146102 0.73 OPRL1 (0.54) MEN1KMT2AOPRL1CYP2D6POLB
SCHEMBL10917431 0.71 POLB (0.42) MEN1KMT2APOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045422-B2 Piperidine derivatives with pesticidal properties SYNGENTA PARTICIPATIONS AG (CH) 2015-06-02 US disclosed
US-9045422-B2 Piperidine derivatives with pesticidal properties SYNGENTA PARTICIPATIONS AG (CH) 2015-06-02 US disclosed
US-9045422-B2 Piperidine derivatives with pesticidal properties SYNGENTA PARTICIPATIONS AG (CH) 2015-06-02 US disclosed
US-20130310399-A1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-21 US disclosed
US-20130310399-A1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-21 US disclosed
US-8546569-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-10-01 US disclosed
US-8546569-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-10-01 US disclosed
US-8546569-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-10-01 US disclosed
EP-1763302-B1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-03-06 EP disclosed
EP-1763302-B1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-03-06 EP disclosed
US-20120270885-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-10-25 US disclosed
US-20120270885-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-10-25 US disclosed
US-20120270885-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-10-25 US disclosed
US-8129534-B2 Chemical compounds SYNGENTA CROP PROTECTION, INC. (US) 2012-03-06 US disclosed
US-20090042938-A1 Chemical Compounds SYNGENTA CROP PROTECTION, INC. (US) 2009-02-12 US disclosed
EP-1763302-A2 CHEMICAL COMPOUNDS Syngeta Participations AG (CH) 2007-03-21 EP disclosed
WO-2006003494-A2 PIPERIDINE DERIVATIVES AND THEIR USE AS INSECTICIDES, ACARICIDES, MOLLUSCICIDES OR NEMATICIDES SYNGENTA PARTICIPATIONS AG (CH) 2006-01-12 WO 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 (3 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-20120270885-A1 CHEMICAL COMPOUNDS H1-0, CHRM1, MRM1 MEN1 219/4885KMT2A 834/4885NPY2R 129/4885
US-20090042938-A1 Chemical Compounds CHRM1, MRM1, H1-0 MEN1 272/4885KMT2A 666/4885NPY2R 138/4885
US-20130310399-A1 CHEMICAL COMPOUNDS ACHE, CHRM1, CHRM2 MEN1 885/4885KMT2A 867/4885NPY2R 167/4885

“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.