SCHEMBL1850589

SCHEMBL1850589

Cc1cc(Cc2noc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)ccc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 6/20 0.44
S1PR3 Q99500 2/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
PPARG P37231 4/20 0.43
PPARA Q07869 4/20 0.43
PPARD Q03181 1/20 0.43
MAPK1 P28482 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL1847192 0.78 HPGD (0.42) LMNASMN1; SMN2MAPK1L3MBTL1MAPT
SCHEMBL2170567 0.76 SKP2 (0.36) LMNASMN1; SMN2MAPK1L3MBTL1MAPT
SCHEMBL550610 0.75 SKP2 (0.45) PPARGMAPTMEN1TSHRKMT2A
SCHEMBL14541587 0.74 S1PR1 (0.54) S1PR1S1PR3SMN1; SMN2PPARGPPARA
SCHEMBL1833339 0.74 SKP2 (0.35) LMNASMN1; SMN2MAPK1L3MBTL1MAPT
SCHEMBL1826287 0.72 SKP2 (0.41) MAPTMEN1TSHRHTTKMT2A
SCHEMBL2431584 0.71 S1PR1 (0.54) S1PR1S1PR3PPARGPPARAPPARD
SCHEMBL27912332 0.71 SKP2 (0.46) MAPTMEN1TSHRKMT2ARAB9A
SCHEMBL2183405 0.70 NPC1 (0.46) S1PR1SMN1; SMN2L3MBTL1MAPTHPGD
SCHEMBL10094745 0.69 LMNA (0.62) S1PR1S1PR3LMNASMN1; SMN2MAPT

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
US-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 S1PR1 2668/4885S1PR3 1647/4885LMNA 1928/4885

“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.