SCHEMBL23911983

SCHEMBL23911983

NN1CCC(c2ccccc2)C(C(=O)N(N)c2cccc(F)c2F)C1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 2/20 0.35
▸ DDB1 Q16531 1/20 0.33
▸ CRBN Q96SW2 1/20 0.33
▸ NOTUM Q6P988 1/20 0.32
▸ KIF11 P52732 2/20 0.32
▸ CCR5 P51681 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL23642644 0.82 MDM2 (0.32) DDB1CRBN
SCHEMBL23642427 0.77 HPGD (0.35) PTGIRDDB1CRBNLMNAKMT2A
SCHEMBL23642606 0.77 TP53 (0.46) ALDH1A1LMNAKMT2A
SCHEMBL22304658 0.76 HTR2B (0.36) KIF11ALDH1A1LMNAKMT2A
SCHEMBL23642424 0.76 RBP4 (0.38) —
SCHEMBL23912012 0.74 MGLL (0.38) NOTUM
SCHEMBL23642556 0.72 HRH3 (0.36) —
SCHEMBL23642705 0.70 NOTUM (0.35) NOTUM
SCHEMBL25895244 0.69 — —
SCHEMBL24576664 0.68 MDM2 (0.37) DDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3601263-B1 NOVEL PYRIDAZINONE HERBICIDES FMC CORP (US) 2021-10-13 — — EP disclosed
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