SCHEMBL7514960

SCHEMBL7514960

Cc1nc(-c2nc(-c3ccc(Cl)c(Cl)c3)c(CCCOc3ccccc3C)o2)c[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CETP P11597 4/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A3 Q01959 2/20 0.33
TP53 P04637 1/20 0.33
PTGS1 P23219 1/20 0.33
EPHX2 P34913 1/20 0.33
PTGS2 P35354 1/20 0.33
SLC6A4 P31645 1/20 0.33
CEPT1 Q9Y6K0 2/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
SLC2A1 P11166 1/20 0.32

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
SCHEMBL124198 0.90 TP53 (0.40) MAPTSMN1; SMN2CETPLMNATSHR
SCHEMBL15111130 0.86 MAPT (0.37) MAPTSMN1; SMN2LMNATSHRHTT
SCHEMBL7503844 0.84 MAPT (0.39) MAPTSMN1; SMN2LMNATSHRHTT
SCHEMBL7510444 0.83 PTGS1 (0.34) PTGS1EPHX2PTGS2RXRARXRB
SCHEMBL7507704 0.83 CYP1A2 (0.38) MAPTSMN1; SMN2LMNATSHRHTT
SCHEMBL7507094 0.83 CETP (0.38) MAPTSMN1; SMN2CETPLMNATSHR
SCHEMBL7511214 0.82 ALDH1A1 (0.39) MAPTSMN1; SMN2LMNATSHRHTT
SCHEMBL4442879 0.82 HSD17B10 (0.38) MAPTSMN1; SMN2TSHRHSD17B10TP53
SCHEMBL7502788 0.81 GCGR (0.34) MAPTLMNATP53FABP3
SCHEMBL7514365 0.80 GCGR (0.35) MAPTSMN1; SMN2TP53FABP3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1206472-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT Takeda Chemical Industries, Ltd. (JP) 2002-05-22 EP disclosed
WO-2001014372-A2 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-01 WO disclosed