SCHEMBL17540458

SCHEMBL17540458

O=C(O/N=C(\CCC1CCCCC1)C(=O)c1ccc(Sc2ccc(C(=O)c3ccco3)cc2)cc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
PKM P14618 1/20 0.39
LMNA P02545 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
TSHR P16473 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL17540444 0.88 L3MBTL1 (0.43) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL17070003 0.88 L3MBTL1 (0.43) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL19795438 0.87 L3MBTL1 (0.44) ALDH1A1SMN1; SMN2PKMLMNANPC1
SCHEMBL17070001 0.87 L3MBTL1 (0.44) ALDH1A1SMN1; SMN2PKMLMNANPC1
SCHEMBL25373230 0.87 L3MBTL1 (0.44) ALDH1A1SMN1; SMN2PKMLMNANPC1
SCHEMBL17540464 0.85 KMT2A (0.50) ALDH1A1SMN1; SMN2PKMLMNANPC1
SCHEMBL17540459 0.83 KMT2A (0.39) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL17655597 0.83 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2PKMLMNANPC1
SCHEMBL17545816 0.83 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2LMNANPC1RAB9A
SCHEMBL17540463 0.83 HPGDS (0.40) ALDH1A1SMN1; SMN2PKMLMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9383480-B2 Photocurable acrylate composition CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-07-05 US disclosed
US-9383480-B2 Photocurable acrylate composition CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-07-05 US disclosed
US-20160047945-A1 PHOTOCURABLE ACRYLATE COMPOSITION CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-02-18 US disclosed
US-20160047945-A1 PHOTOCURABLE ACRYLATE COMPOSITION CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-02-18 US disclosed