SCHEMBL12438374

SCHEMBL12438374

N#Cc1ccc(C(=O)Nc2c(Cl)cc(C(F)(c3ccc(Cl)cc3)C(F)(F)F)cc2Cl)cc1NC(=O)c1c(F)cc(F)cc1F

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 12/20 0.39
S1PR1 P21453 6/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
KCNQ3 O43525 1/20 0.36
KCNQ2 O43526 1/20 0.36
KCNE1 P15382 1/20 0.36
KCNQ1 P51787 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL14120380 0.87 TRPV1 (0.46) S1PR3S1PR1RAB9ANPC1HDAC1
SCHEMBL12437133 0.87 TAS1R3 (0.40) S1PR3S1PR1RAB9AHDAC1HDAC8
SCHEMBL18023968 0.86 HDAC1 (0.42) S1PR3S1PR1RAB9AHDAC1HDAC8
SCHEMBL14121227 0.84 PNLIP (0.38) S1PR3S1PR1RAB9ANPC1KCNQ3
SCHEMBL12437616 0.83 ALDH1A1 (0.46) S1PR3S1PR1RAB9ANPC1MEN1
SCHEMBL12437620 0.82 MEN1 (0.46) S1PR3S1PR1HDAC1HDAC8HDAC6
SCHEMBL12437132 0.81 S1PR3 (0.40) S1PR3S1PR1RAB9ACYP1A2CYP2D6
SCHEMBL16330798 0.81 S1PR3 (0.52) S1PR3S1PR1
SCHEMBL14120559 0.78 LMNA (0.48) S1PR3S1PR1MEN1KMT2A
SCHEMBL12437547 0.78 S1PR3 (0.43) S1PR3S1PR1MEN1KMT2A

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-2531484-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-08-17 EP disclosed
US-20120309812-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-12-06 US disclosed
WO-2011095462-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2011-08-11 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 (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-20120309812-A1 INSECTICIDAL COMPOUNDS ACHE, AADAC, NISCH S1PR3 1546/4885S1PR1 2246/4885RAB9A 80/4885

“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.