SCHEMBL5708102

SCHEMBL5708102

C(=Cc1cccc(-c2nc3ccccc3s2)c1-c1nc2ccccc2s1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.49
NPC1 O15118 9/20 0.49
RAB9A P51151 9/20 0.49
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 6/20 0.49
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
MAPT P10636 6/20 0.49
GAA P10253 6/20 0.49
L3MBTL1 Q9Y468 4/20 0.49
TDP1 Q9NUW8 3/20 0.49
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 3/20 0.42
ILK Q13418 4/20 0.41
GLA P06280 2/20 0.41
DHFR P00374 1/20 0.41
HCRTR1 O43613 1/20 0.41
TP53 P04637 2/20 0.41
S1PR2 O95136 1/20 0.41
CYP1A2 P05177 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
SCHEMBL3355189 0.89 KDM4E (0.54) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3355183 0.89 KDM4E (0.54) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5708098 0.81 KDM4E (0.62) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL17270111 0.74 ILK (0.62) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL27536788 0.74 SMN1; SMN2 (0.46) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL231307 0.74 KDM4E (0.75) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL12776948 0.73 KDM4E (0.43) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL2475992 0.72 KDM4E (0.58) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL11676970 0.72 KDM4E (0.58) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL12854008 0.72 KDM4E (0.72) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1325067-B1 MULTI-COMPONENT OPTICALLY BRIGHTENED POLYOLEFIN BLEND EASTMAN CHEM CO (US) 2006-09-06 EP disclosed
EP-1325067-A1 MULTI-COMPONENT OPTICALLY BRIGHTENED POLYOLEFIN BLEND EASTMAN CHEMICAL COMPANY (US) 2003-07-09 EP disclosed
US-6492032-B1 MIXTURE OF BENZOXAZOLYL STILBENES WITH A BIS(BENZOXAZOLYL)-NAPHTHALENE, BIS(BENZOXAZOLYL)THIOPHENE, A PYRAZOLINE AND/OR A COURMARIN; PHOTOGRAPHIC FILMS EASTMAN CHEMICAL COMPANY 2002-12-10 US disclosed
WO-2002031035-A1 MULTI-COMPONENT OPTICALLY BRIGHTENED POLYOLEFIN BLEND EASTMAN CHEMICAL COMPANY (US) 2002-04-18 WO disclosed
US-4363744-A Mixtures of optical brighteners and their use for the optical brightening HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-14 US disclosed
US-4363744-A Mixtures of optical brighteners and their use for the optical brightening HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-14 US disclosed
US-4169810-A BENZOXAZOLYLSTILBENE, BENZOTHIAZOLYLSTILBENE HOECHST AKTIENGESELLSCHAFT (DE) 1979-10-02 US disclosed