SCHEMBL8311101

SCHEMBL8311101

Oc1ccc2oc(-c3nc4c(s3)CCCC4)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LMNA P02545 2/20 0.48
GLA P06280 2/20 0.48
GAA P10253 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
APP P05067 7/20 0.43
PDE4D Q08499 3/20 0.38
FLT3 P36888 1/20 0.37
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
CASP1 P29466 1/20 0.35

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
SCHEMBL8312015 0.81 APP (0.46) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL8311014 0.74 MAPT (0.42) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL8315007 0.72 NPC1 (0.40) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL27294716 0.70 ESR1 (0.49) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL8310912 0.67 MIF (0.54) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL8314981 0.67 ESR1 (0.44) NPC1MAPTRAB9AESR1ESR2
SCHEMBL8311404 0.67 ESR1 (0.48) KDM4EALDH1A1LMNAGAANPC1
SCHEMBL31677643 0.66 SNCA (0.50) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL8311480 0.66 ESR1 (0.47) NPC1MAPTRAB9AESR1ESR2
SCHEMBL8315342 0.66 ESR1 (0.47) KDM4EALDH1A1LMNAGLAGAA

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
EP-0528337-B1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1999-10-20 EP disclosed
US-5296495-A Antiallergens, antiinflammatory FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-22 US disclosed
EP-0528337-A1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-24 EP disclosed