SCHEMBL23642604

SCHEMBL23642604

NN1CCC(c2ccc(C(F)(F)F)cc2)C(C(=O)Nc2ccccc2F)C1=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 1/20 0.48
▸ TSHR P16473 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAOB P27338 1/20 0.42
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ EPHX2 P34913 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PTGS1 P23219 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL23911981 0.89 TRPM8 (0.47) TRPM8TSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL18815749 0.82 TRPM8 (0.46) TRPM8TSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL18281125 0.82 TRPM8 (0.46) TRPM8TSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL23642606 0.82 TP53 (0.46) TSHRSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL30553815 0.81 ALDH1A1 (0.47) TRPM8TSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL17396678 0.81 ALDH1A1 (0.47) TRPM8TSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL20044311 0.81 TP53 (0.41) TRPM8TSHRMEN1KMT2A
SCHEMBL23911985 0.81 ROCK2 (0.40) TSHRSMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL20044882 0.80 TRPM8 (0.46) TRPM8TSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL20044314 0.78 MEN1 (0.46) TSHRALDH1A1LMNAMEN1KMT2A

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-3368523-B1 NOVEL PYRIDAZINONE HERBICIDES FMC CORP (US) 2021-07-14 — — EP disclosed
Send feedback