SCHEMBL4222835

SCHEMBL4222835

CCn1cc(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)c(F)c2)c(C(F)F)n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 14/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
CHRM2 P08172 3/20 0.37
CHRM1 P11229 3/20 0.37
ALOX15 P16050 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
SCHEMBL4226392 0.94 CHRM3 (0.47) CHRM3NPC1RAB9AL3MBTL1CHRM2
SCHEMBL14512374 0.90 NPC1 (0.43) CHRM3NPC1RAB9ALMNAMAPT
SCHEMBL303047 0.90 CHRM3 (0.51) CHRM3TAS1R3TAS1R1TAS1R2CHRM2
SCHEMBL29688317 0.90 CHRM3 (0.51) CHRM3TAS1R3TAS1R1TAS1R2CHRM2
SCHEMBL14065946 0.86 CHRM3 (0.46) CHRM3NPC1RAB9ALMNAMAPT
SCHEMBL5564889 0.85 CHRM3 (0.47) CHRM3CHRM2CHRM1ALOX15
SCHEMBL20986957 0.83 LMNA (0.47) CHRM3LMNAMAPT
SCHEMBL29349968 0.83 CHRM3 (0.51) CHRM3LMNACHRM2CHRM1ALOX15
SCHEMBL68043 0.83 CHRM3 (0.51) CHRM3LMNACHRM2CHRM1ALOX15
SCHEMBL29445383 0.83 CHRM3 (0.51) CHRM3LMNACHRM2CHRM1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069398-A1 Pyrazolyl Carboxamides BAYER CROPSCIENCE AG (DE) 2009-03-12 US disclosed
US-20090069398-A1 Pyrazolyl Carboxamides BAYER CROPSCIENCE AG (DE) 2009-03-12 US disclosed
US-20090069398-A1 Pyrazolyl Carboxamides BAYER CROPSCIENCE AG (DE) 2009-03-12 US disclosed
WO-2007068370-A2 PYRAZOLYL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2007-06-21 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-20090069398-A1 Pyrazolyl Carboxamides MRPL21, AADAC, PGLS CHRM3 2776/4885NPC1 3869/4885RAB9A 2647/4885

“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.