SCHEMBL21799557

SCHEMBL21799557

CCC(C)NCc1ccccc1CN

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
POLB P06746 2/20 0.41
MAPK1 P28482 1/20 0.41
SIGMAR1 Q99720 2/20 0.39
KDM4E B2RXH2 2/20 0.38
LTA4H P09960 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PNMT P11086 1/20 0.36
TP53 P04637 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL21799758 0.86 LMNA (0.41) LMNAPOLBMAPK1SIGMAR1KDM4E
SCHEMBL21800067 0.84 LMNA (0.45) LMNAPOLBMAPK1SIGMAR1KDM4E
SCHEMBL21799898 0.83 KDM4E (0.43) LMNAPOLBMAPK1KDM4EALDH1A1
SCHEMBL21799635 0.83 LMNA (0.39) LMNAPOLBMAPK1SIGMAR1KDM4E
SCHEMBL21800071 0.82 BCHE (0.47) LMNAPOLBMAPK1ALDH1A1PNMT
SCHEMBL21799792 0.82 PNMT (0.34) LMNAPOLBMAPK1SIGMAR1KDM4E
SCHEMBL21799495 0.82 PNMT (0.34) LMNAPOLBMAPK1ALDH1A1L3MBTL1
SCHEMBL21799595 0.79 PNMT (0.38) LMNAPOLBMAPK1SIGMAR1KDM4E
SCHEMBL172673 0.78 POLB (0.66) POLBMAPK1KDM4EALDH1A1TSHR
SCHEMBL19091174 0.78 POLB (0.66) POLBMAPK1KDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124593-B2 Modified block copolymer, method for producing modified block copolymer, and resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
US-20200199282-A1 Modified Block Copolymer, Method for Producing Modified Block Copolymer, and Resin Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-06-25 US disclosed
EP-3623398-A1 MODIFIED BLOCK COPOLYMER, METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER, AND RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2020-03-18 EP disclosed