SCHEMBL10729336

SCHEMBL10729336

CCCCN(CCCC)C(=O)C1CCCN(C)C1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 7/20 0.67
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ DUSP22 Q9NRW4 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HTT P42858 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
SCHEMBL1375400 0.84 BCHE (0.62) BCHEALDH1A1KDM4EHPGDHTT
SCHEMBL10735407 0.81 BCHE (0.62) BCHEALDH1A1TSHRSIGMAR1KDM4E
Iodide SCHEMBL10608917 0.81 BCHE (0.85) BCHEKDM4E
Iodide SCHEMBL10607340 0.81 BCHE (0.85) BCHEKDM4E
SCHEMBL14230104 0.79 BCHE (0.55) BCHESIGMAR1
SCHEMBL14354706 0.79 CNR2 (0.53) BCHESIGMAR1
SCHEMBL13614167 0.76 BCHE (0.63) BCHEALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL15254340 0.76 L3MBTL1 (0.50) BCHEALDH1A1TSHRSIGMAR1KDM4E
SCHEMBL15254338 0.76 L3MBTL1 (0.50) BCHEALDH1A1TSHRSIGMAR1KDM4E
SCHEMBL15254560 0.76 L3MBTL1 (0.50) BCHEALDH1A1TSHRSIGMAR1KDM4E

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
US-4634709-A PIPERIDINE DERIVATIVES RESEARCH CORPORATION (US) 1987-01-06 — — US claimed
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