SCHEMBL9895140

SCHEMBL9895140

CCc1cc(C(F)(C(F)(F)F)C(F)(F)F)cc(C)c1NC(=O)c1ccc(CN)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.36
S1PR2 O95136 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR5 Q9H228 1/20 0.36
CHRNA7 P36544 1/20 0.35
KLKB1 P03952 5/20 0.35
HIF1A Q16665 2/20 0.35
EPAS1 Q99814 1/20 0.35
CD274 Q9NZQ7 4/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
PDCD1 Q15116 2/20 0.34
MAPT P10636 2/20 0.34
TRPV1 Q8NER1 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL1274623 0.95 S1PR1 (0.34) S1PR1S1PR2S1PR4S1PR5CHRNA7
SCHEMBL1275826 0.85 KDM4E (0.40) TRPV1KDM4EMEN1ALDH1A1LMNA
SCHEMBL1274944 0.84 HDAC3 (0.40) S1PR1S1PR2S1PR4S1PR5KLKB1
SCHEMBL9894275 0.82 BACE1 (0.40) LMNACYP1A2CYP3A4
SCHEMBL9895253 0.82 S1PR4 (0.39) S1PR1S1PR2S1PR4S1PR5CHRNA7
SCHEMBL1274575 0.81 LOXL2 (0.44) S1PR1S1PR2S1PR4S1PR5KLKB1
SCHEMBL1274558 0.80 MAP3K5 (0.36) HIF1AEPAS1MAPTTRPV1KDM4E
SCHEMBL1274338 0.80 ALDH1A1 (0.39) S1PR1S1PR2S1PR4S1PR5KLKB1
SCHEMBL1274590 0.79 S1PR1 (0.35) S1PR1S1PR2S1PR4S1PR5CHRNA7
SCHEMBL1274328 0.78 ALDH1A1 (0.42) MAPTKDM4EALDH1A1LMNACYP1A2

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-3153497-A2 PESTICIDAL CARBOXAMIDES Bayer Cropscience AG (DE) 2017-04-12 EP disclosed
US-9227923-B2 Pesticidal carboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-05 US disclosed
US-20120149910-A1 Pesticidal Carboxamides BAYER CROPSCIENCE AG (DE) 2012-06-14 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-20120149910-A1 Pesticidal Carboxamides DDT, ACHE, AADAC S1PR1 2164/4885S1PR2 1659/4885S1PR4 2004/4885

“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.