SCHEMBL20832172

SCHEMBL20832172

C[C@@H]1CN(Cc2ccccc2C(F)(F)F)CCN1c1cnn(C)c(=O)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 3/20 0.44
▸ KDM4E B2RXH2 6/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ ATM Q13315 3/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KAT2B Q92831 5/20 0.42
▸ TACR1 P25103 2/20 0.42
▸ P2RX7 Q99572 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ TRPC4 Q9UBN4 1/20 0.41
▸ C5AR1 P21730 1/20 0.41

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
SCHEMBL20832171 0.86 TRPC5 (0.59) TRPC5KDM4EKMT2AKAT2B
SCHEMBL20831652 0.84 TRPC5 (0.59) TRPC5KDM4EALDH1A1ATMNPSR1
SCHEMBL20831508 0.73 TRPC5 (0.57) TRPC5KDM4EALDH1A1ATMNPSR1
SCHEMBL20831959 0.70 TRPC5 (0.42) TRPC5P2RX7KCNH2TRPC4C5AR1
SCHEMBL20831647 0.69 TRPC5 (0.78) TRPC5ALDH1A1KCNH2TRPC4
SCHEMBL20831958 0.69 TRPC5 (0.68) TRPC5KCNH2TRPC4
SCHEMBL20831554 0.69 TRPC5 (0.68) TRPC5KCNH2TRPC4
SCHEMBL20831957 0.69 TRPC5 (0.68) TRPC5KCNH2TRPC4
SCHEMBL25699755 0.68 TRPC5 (0.35) TRPC5KAT2BMAPT
SCHEMBL20831868 0.67 TRPC5 (0.60) TRPC5ALDH1A1POLBKCNH2TRPC4

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-2019055966-A2 PYRIDAZINONES AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-03-21 — — WO disclosed
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