SCHEMBL15947351

SCHEMBL15947351

CNCc1ccc(S(=O)(=O)NCCOCCO)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.57
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 4/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MAPT P10636 1/20 0.47
USP2 O75604 1/20 0.45
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HTT P42858 2/20 0.43
ALOX15 P16050 1/20 0.43
CYP19A1 P11511 1/20 0.42
CYP2C19 P33261 1/20 0.42
NAMPT P43490 1/20 0.42
TSHR P16473 3/20 0.42
CDK1 P06493 1/20 0.41
CDK2 P24941 1/20 0.41

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
SCHEMBL14853588 0.85 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL8404645 0.83 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL7776599 0.82 ALDH1A1 (0.84) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL26219802 0.81 ALDH1A1 (0.82) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL23476689 0.80 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL5893917 0.80 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL8612141 0.79 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL14132270 0.79 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL30325135 0.78 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL30325179 0.78 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E

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-20140227780-A1 METHOD FOR PRODUCING MEGAKARYOCYTES AND/OR PLATELETS FROM PLURIPOTENT STEM CELLS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-08-14 US disclosed