SCHEMBL27576643

SCHEMBL27576643

CCCCNC(=O)C1=CC=CN(CC(=O)Nc2ccccc2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.42
GAA P10253 1/20 0.40
NAMPT P43490 3/20 0.40
NAAA Q02083 1/20 0.40
PPARG P37231 1/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ENPP2 Q13822 1/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
BCL2 P10415 1/20 0.38
MCL1 Q07820 1/20 0.38
ICMT O60725 1/20 0.38
ALB P02768 1/20 0.38

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
SCHEMBL27573479 0.88 ALDH1A1 (0.43) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL27579366 0.82 MEN1 (0.44) ALDH1A1TSHRNAMPTHPGDMAPT
SCHEMBL27573192 0.81 SMN1; SMN2 (0.43) HTTALDH1A1NAMPTMAPTLMNA
SCHEMBL27475349 0.81 ALDH1A1 (0.41) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL659235 0.76 HTT (0.45) EPHX1HTTALDH1A1TSHRGAA
SCHEMBL27473204 0.75 CHRNB2 (0.46) HTTALDH1A1TSHRGAAMAPT
SCHEMBL27573158 0.74 MAPT (0.43) ALDH1A1GAAMAPTLMNAMEN1
SCHEMBL27573226 0.74 ALDH1A1 (0.50) ALDH1A1GAAHPGDL3MBTL1LMNA
SCHEMBL27591874 0.71 SMN1; SMN2 (0.38) HTTALDH1A1TSHRNAMPTHPGD
SCHEMBL27457217 0.69 POLB (0.46) EPHX1ALDH1A1TSHRGAAMAPT

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
CN-1411800-A Cosmetic composition and method TORENTO PHARMACEUTICAL CO LTD (IN) 2003-04-23 CN disclosed
CN-1411809-A Usage and composition of pyridine onium derivative for curing application TORENTO PHARMACEUTICAL CO LTD (IN) 2003-04-23 CN disclosed