SCHEMBL19601176

SCHEMBL19601176

CCC(Cc1ccc(C(=O)N2CCN(C=O)CC2)cc1)(C(=O)c1ccc(N2CCNCC2)cc1)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
MCL1 Q07820 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 2/20 0.37
MAPKAPK2 P49137 2/20 0.37
AKR1C1 Q04828 1/20 0.36
CHRNA10 Q9GZZ6 1/20 0.36
CHRNA9 Q9UGM1 1/20 0.36
MAPT P10636 1/20 0.36
MAPK10 P53779 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL19601159 0.93 LMNA (0.43) LMNAKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL17269404 0.91 HPGD (0.44) LMNAKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL19601364 0.90 LMNA (0.40) LMNAKMT2AMEN1MCL1ALDH1A1
SCHEMBL21480958 0.90 HRH3 (0.43) LMNAKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL17269417 0.89 CHRNA10 (0.46) LMNAKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL2704646 0.88 ALDH1A1 (0.45) LMNAALDH1A1HSD17B10USP2TSHR
SCHEMBL17269400 0.88 HPGD (0.43) LMNAKMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL17269381 0.86 SMN1; SMN2 (0.42) LMNAKMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL21477316 0.85 MAPKAPK2 (0.41) LMNAALDH1A1HSD17B10USP2TSHR
SCHEMBL19601192 0.85 LMNA (0.37) LMNAKMT2AMEN1ALDH1A1HSD17B10

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-2017195428-A1 NOVEL COMPOUND, PHOTOCURABLE COMPOSITION, CURED PRODUCT THEREOF, PRINTING INK, AND PRINTED MATTER USING PRINTING INK DIC株式会社 2017-11-16 WO disclosed