SCHEMBL9818902

SCHEMBL9818902

O=C(O)CC1C[C@H](Cc2ccc(Cl)cc2)Oc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.41
TBXA2R P21731 8/20 0.40
PTGDR Q13258 8/20 0.40
TSHR P16473 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FFAR1 O14842 4/20 0.36
PPARG P37231 2/20 0.36
PPARD Q03181 2/20 0.36
HTT P42858 1/20 0.36
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
PDE2A O00408 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
SCHEMBL9818900 1.00 MAOB (0.41) MAOBTBXA2RPTGDRTSHRNPC1
SCHEMBL9819044 0.91 LTB4R (0.43) MAOBSMN1; SMN2FFAR1PPARGPPARD
SCHEMBL9819040 0.91 LTB4R (0.43) MAOBSMN1; SMN2FFAR1PPARGPPARD
SCHEMBL9819065 0.87 FFAR1 (0.41) FFAR1PPARGPPARD
SCHEMBL9819060 0.87 FFAR1 (0.41) FFAR1PPARGPPARD
SCHEMBL9818925 0.85 MEN1 (0.48) NPC1RAB9ASMN1; SMN2FFAR1PPARG
SCHEMBL9818920 0.85 MEN1 (0.48) NPC1RAB9ASMN1; SMN2FFAR1PPARG
SCHEMBL27277358 0.82 CCR2 (0.43) MAOB
SCHEMBL9819039 0.79 HTT (0.40) FFAR1PPARGPPARDHTT
SCHEMBL9819041 0.79 HTT (0.40) FFAR1PPARGPPARDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230379-B1 CHROMAN- AND THIOCHROMAN-4-ACETIC ACIDS USEFUL IN THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1991-04-03 EP disclosed