SCHEMBL23925233

SCHEMBL23925233

CC(=O)Nc1ccc2c(C(F)(F)F)cc(O)nc2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
MAP2K1 Q02750 1/20 0.42
SORT1 Q99523 1/20 0.41
ADORA3 P0DMS8 3/20 0.40
KCNJ11 Q14654 1/20 0.40
ADORA1 P30542 3/20 0.38
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 1/20 0.38
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
PIK3CA P42336 3/20 0.37
PIK3CD O00329 2/20 0.37
PIK3CB P42338 2/20 0.37
PIK3CG P48736 2/20 0.37
PIK3C3 Q8NEB9 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
SCHEMBL29989882 0.85 ALDH1A1 (0.46) GAAALDH1A1MAPTRAB9AMAP2K1
SCHEMBL25174407 0.85 ALDH1A1 (0.46) GAAALDH1A1MAPTRAB9AMAP2K1
SCHEMBL5363593 0.80 XIAP (0.52) ALDH1A1MAPTADORA3ADORA1KDM4E
SCHEMBL9378955 0.76 KDM4E (0.38) GAAALDH1A1MAPTADORA3ADORA1
SCHEMBL11591216 0.75 ADORA1 (0.51) ALDH1A1MAPTADORA3ADORA1KDM4E
SCHEMBL9381323 0.73 XIAP (0.41) GAAADORA3ADORA1KDM4EMAPK13
SCHEMBL14879442 0.72 ALDH1A1 (0.69) GAAALDH1A1MAPTRAB9AKDM4E
SCHEMBL11491259 0.70 XIAP (0.68) ALDH1A1ADORA3ADORA1KDM4EKMT2A
SCHEMBL9381376 0.69 MAPK8 (0.40) GAAMAPTADORA3ADORA1KDM4E
SCHEMBL5365213 0.68 XIAP (0.51) ALDH1A1MAPTRAB9ASORT1ADORA3

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-20230141433-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF CHEMICALS INDIA PVT. LTD. (IN) 2023-05-11 US disclosed
EP-4136086-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2023-02-22 EP disclosed
WO-2021209265-A1 TRICYCLIC PESTICIDAL COMPOUNDS BASF SE (DE) 2021-10-21 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-20230141433-A1 TRICYCLIC PESTICIDAL COMPOUNDS DDT, ACHE, PFAS GAA 1779/4885ALDH1A1 813/4885MAPT 3053/4885

“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.