SCHEMBL5708178

SCHEMBL5708178

c1ccc2c(-c3nc4ccccc4s3)c(-c3nc4ccccc4s3)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.53
NPC1 O15118 9/20 0.53
RAB9A P51151 9/20 0.53
ALDH1A1 P00352 7/20 0.53
MAPT P10636 6/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
GAA P10253 4/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
TDP1 Q9NUW8 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
ILK Q13418 5/20 0.47
GLA P06280 2/20 0.47
HCRTR1 O43613 1/20 0.47
HSD17B10 Q99714 3/20 0.46
TP53 P04637 2/20 0.46
TSHR P16473 1/20 0.46
APP P05067 2/20 0.46
POLB P06746 2/20 0.46

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
SCHEMBL28784795 0.86 MAPT (0.56) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL2225061 0.83 KDM4E (0.64) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL13241653 0.83 KDM4E (0.59) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL30689066 0.83 KDM4E (0.64) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL24156044 0.83 CYP2A6 (0.46) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL804637 0.83 RAB9A (0.51) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL30714924 0.83 RAB9A (0.59) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL196651 0.83 RAB9A (0.59) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL13197400 0.81 ILK (0.54) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL8854935 0.81 RAB9A (0.50) KDM4ENPC1RAB9AALDH1A1MAPT

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 5 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-4129412-A 4-BENZOOXAZOL-2-YL-STILBENES HOECHST AKTIENGESELLSCHAFT (DE) 1978-12-12 US disclosed