SCHEMBL7212235

SCHEMBL7212235

CCCCCN(C)CCCCOC1CCC(N(C)C(=O)Nc2ccc(C)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
RAB9A P51151 1/20 0.40
NPY5R Q15761 2/20 0.39
KMT2A Q03164 1/20 0.39
LSS P48449 2/20 0.37
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
PTBP1 P26599 1/20 0.36
ABCC1 P33527 1/20 0.35
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 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
SCHEMBL7212232 1.00 ATM (0.40) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7208470 0.91 LSS (0.47) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7208465 0.91 LSS (0.47) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7205075 0.90 ALDH1A1 (0.46) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7210327 0.90 HPGD (0.42) ATMRAB9AALDH1A1UBE2MDCUN1D1
SCHEMBL7205235 0.90 FPR3 (0.42) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7209436 0.90 FPR3 (0.42) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7205073 0.90 ALDH1A1 (0.46) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7206024 0.90 LSS (0.48) ATMRAB9ANPY5RKMT2ALSS
SCHEMBL7209439 0.90 FPR3 (0.42) ATMRAB9ANPY5RKMT2ALSS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed