SCHEMBL22812221

SCHEMBL22812221

CCCC(C)N1CCN(C(=O)C(O)c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 5/20 0.50
▸ KDM4E B2RXH2 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ GAA P10253 1/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ CNR1 P21554 1/20 0.44
▸ CNR2 P34972 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ MCL1 Q07820 1/20 0.42
▸ CACNA1H O95180 1/20 0.42
▸ CACNA2D1 P54289 1/20 0.42
▸ CACNA1B Q00975 1/20 0.42
▸ CACNB1 Q02641 1/20 0.42
▸ CACNA1C Q13936 1/20 0.42

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
SCHEMBL18390264 0.83 CHRM1 (0.65) CHRM1ALDH1A1KMT2AMEN1
SCHEMBL20353685 0.80 CHRM1 (0.51) CHRM1KDM4ETSHRALDH1A1KMT2A
SCHEMBL4874415 0.77 CES2 (0.50) CHRM1KDM4ETSHRALDH1A1GAA
SCHEMBL29522101 0.76 CHRM1 (0.63) CHRM1TSHRGAA
SCHEMBL18390258 0.76 CHRM1 (0.63) CHRM1TSHRGAA
SCHEMBL20160374 0.75 ROCK2 (0.35) CHRM1KDM4ETSHRMCL1
SCHEMBL23449305 0.71 PIK3CD (0.48) KDM4ETSHRALDH1A1KMT2AMCL1
SCHEMBL9910968 0.71 KCNQ2 (0.56) CHRM1KDM4ETSHRALDH1A1GAA
SCHEMBL13149986 0.70 GAA (0.66) CHRM1KDM4ETSHRALDH1A1GAA
SCHEMBL14359456 0.70 LMNA (0.47) CHRM1ALDH1A1KMT2AMEN1LMNA

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-3753939-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS Array Biopharma Inc. (US) 2020-12-23 — — EP disclosed
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