SCHEMBL8312254

SCHEMBL8312254

COc1ccc2oc(-c3nc4c(s3)NCCCC4)cc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.42
F2RL3 Q96RI0 3/20 0.41
KDM4E B2RXH2 6/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ATM Q13315 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
ALDH1A1 P00352 5/20 0.39
HPGD P15428 3/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
MAOA P21397 1/20 0.37
THRB P10828 1/20 0.37
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
PTGES O14684 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36

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 0.83 APP (0.46) APPF2RL3KDM4ERAB9ASMN1; SMN2
SCHEMBL8316374 0.77 MAPT (0.49) KDM4ERAB9ASMN1; SMN2ALDH1A1HPGD
Hydrochloric Acid SCHEMBL8312117 0.77 RAB9A (0.42) KDM4ERAB9ASMN1; SMN2ALDH1A1MAPT
Hydrochloric Acid SCHEMBL8315810 0.76 CYP1A1 (0.45) KDM4ERAB9ASMN1; SMN2ATMALDH1A1
SCHEMBL8315597 0.76 APP (0.41) APPF2RL3KDM4ERAB9ASMN1; SMN2
SCHEMBL8314147 0.75 F2RL3 (0.31) F2RL3
Hydrochloric Acid SCHEMBL8314842 0.70 KDM4E (0.44) KDM4EALDH1A1HPGDGAAMAOB
SCHEMBL8317000 0.70 CYP1A1 (0.44) KDM4EALDH1A1MAPTNPC1
SCHEMBL8316999 0.70 CYP1A1 (0.44) KDM4EALDH1A1MAPTNPC1
SCHEMBL8317005 0.69 KDM4E (0.42) KDM4ERAB9ASMN1; SMN2ALDH1A1HPGD

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