SCHEMBL9505469

SCHEMBL9505469

FC(F)(F)C(F)(F)c1nnc(Cl)s1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.36
ALDH1A1 P00352 1/20 0.33
ATM Q13315 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9505463 0.86 ALDH1A1 (0.35) FBP1ALDH1A1
SCHEMBL701494 0.80 ALDH1A1 (0.52) FBP1ALDH1A1ATMMEN1KMT2A
SCHEMBL9509498 0.78 FBP1 (0.37) FBP1ALDH1A1ATMMEN1KMT2A
SCHEMBL13822033 0.71 ALDH1A1 (0.33) ALDH1A1
SCHEMBL11615294 0.71 ALDH1A1 (0.67) FBP1ALDH1A1
SCHEMBL10666440 0.67 FBP1 (0.33) FBP1
SCHEMBL22804308 0.67 SMN1; SMN2 (0.39) ALDH1A1MEN1KMT2A
SCHEMBL6364119 0.66
SCHEMBL12186574 0.60 ALDH1A1 (0.64) FBP1ALDH1A1
SCHEMBL31339479 0.58 ALDH1A1 (0.65) ALDH1A1ATMMEN1KMT2A

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
EP-0348737-B1 HETEROARYLOXY-ACETIC ACID N-ISOPROPYL ANILIDES BAYER AG (DE) 1993-08-04 EP disclosed
US-5090991-A HERBICIDAL N-ISOPROPYLHETEROARYLOXYACETANILIDES BAYER AKATIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
US-4968342-A PRE-AND POSTEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1990-11-06 US disclosed
EP-0348737-A1 Heteroaryloxy-acetic acid N-isopropyl anilides BAYER AG (DE) 1990-01-03 EP disclosed