SCHEMBL21152690

SCHEMBL21152690

C=C(C)C(C)(C)OC(=O)N1CCN(c2ccc(N)nc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPC6 Q9Y210 3/20 0.45
▸ GPR119 Q8TDV5 4/20 0.45
▸ MAPT P10636 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ GCK P35557 1/20 0.41
▸ GCKR Q14397 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ SYK P43405 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ WNT3A P56704 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ ALK Q9UM73 2/20 0.39
▸ AOC3 Q16853 1/20 0.39
▸ PTPN11 Q06124 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
SCHEMBL1393764 0.87 MAPT (0.56) TRPC6GPR119MAPTALDH1A1KMT2A
SCHEMBL29426702 0.87 MAPT (0.56) TRPC6GPR119MAPTALDH1A1KMT2A
SCHEMBL29437363 0.85 GPR119 (0.55) TRPC6GPR119MAPTALDH1A1KMT2A
SCHEMBL26641577 0.85 MAPT (0.58) TRPC6GPR119MAPTALDH1A1KMT2A
Ammonia Solution, Strong SCHEMBL28415331 0.85 GPR119 (0.55) TRPC6GPR119MAPTALDH1A1KMT2A
SCHEMBL6435318 0.83 TRPC6 (0.48) TRPC6MAPTALDH1A1KMT2ALMNA
SCHEMBL30316131 0.82 CKS1B (0.53) TRPC6GPR119MAPTALDH1A1KMT2A
SCHEMBL1990159 0.82 CKS1B (0.53) TRPC6GPR119MAPTALDH1A1KMT2A
SCHEMBL21153536 0.82 MAPT (0.54) GPR119MAPTALDH1A1KMT2ALMNA
SCHEMBL30643550 0.81 GPR119 (0.52) TRPC6GPR119MAPTALDH1A1KMT2A

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-3204378-B1 N-PYRIDINYL ACETAMIDE DERIVATIVES AS INHIBITORS OF THE WNT SIGNALLING PATHWAY REDX PHARMA PLC (GB) 2019-07-10 — — EP disclosed
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