SCHEMBL16434616

SCHEMBL16434616

COC(=O)C(CC1CCN(C)CC1)NC(=O)Cc1cc(C)ccc1C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 11/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
YAP1 P46937 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CCR3 P51677 1/20 0.37

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
SCHEMBL12687855 0.92 MEN1 (0.40) CHRM3MEN1KMT2AYAP1SMN1; SMN2
SCHEMBL12505895 0.91 MEN1 (0.38) CHRM3MEN1KMT2AYAP1SMN1; SMN2
SCHEMBL16434615 0.86 ADAMTS4 (0.39) KMT2A
SCHEMBL16434636 0.86 USP2 (0.38) MEN1KMT2A
SCHEMBL12688030 0.85 KMT2A (0.40) CHRM3MEN1KMT2ASMN1; SMN2CCR3
SCHEMBL16434635 0.84 YAP1 (0.39) CHRM3YAP1
SCHEMBL16434637 0.82 MEN1 (0.38) CHRM3MEN1KMT2ACCR3
SCHEMBL16434640 0.74 TP53 (0.36) MEN1KMT2ASMN1; SMN2
SCHEMBL12505886 0.74 YAP1 (0.38) YAP1
SCHEMBL12687639 0.71 MAPK8 (0.39) MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2661424-B1 4-(ORTHO-SUBSTITUTED-PHENYL)-5-OXO-2,5-DIHYDRO-1H-PYRROLE COMPOUNDS AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2016-10-12 EP disclosed
US-8946453-B2 Chemical compounds SYNGENTA PARTICIPATIONS AG (CH) 2015-02-03 US disclosed
US-20140011845-A1 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-01-09 US 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-20140011845-A1 CHEMICAL COMPOUNDS CYP1B1, CYP1A1, NQO1 CHRM3 2072/4885MEN1 409/4885KMT2A 4015/4885

“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.