SCHEMBL22337481

SCHEMBL22337481

CN1CCC(C(=O)Nc2cccc(F)c2C(F)(F)F)C1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 3/20 0.43
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ TSHR P16473 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP1A2 P05177 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ THRB P10828 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ EPHX2 P34913 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PKM P14618 1/20 0.35
▸ RIPK1 Q13546 1/20 0.35

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
SCHEMBL22337500 1.00 P2RX7 (0.43) P2RX7MEN1KMT2ATSHRSMN1; SMN2
SCHEMBL22337310 0.92 MEN1 (0.39) P2RX7MEN1KMT2ATSHRSMN1; SMN2
SCHEMBL30486800 0.85 TP53 (0.51) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL22337503 0.85 TP53 (0.51) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL22337322 0.85 TP53 (0.51) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL30486807 0.85 KMT2A (0.53) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL21662059 0.85 KMT2A (0.53) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL30486811 0.85 KMT2A (0.53) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL22309591 0.81 TYK2 (0.46) MEN1KMT2ATSHRSMN1; SMN2MAPT
SCHEMBL22591707 0.79 TP53 (0.49) MEN1KMT2ATSHRSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020161147-A1 HERBICIDAL MIXTURES SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO disclosed
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