SCHEMBL8776929

SCHEMBL8776929

Nc1ccc(Oc2ccc(CCc3ccc(Oc4ccc(N)cc4)c(Cl)c3)cc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.55
FFAR1 O14842 2/20 0.49
CYP19A1 P11511 1/20 0.49
GLA P06280 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ACACB O00763 3/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
TAAR1 Q96RJ0 2/20 0.44
TAAR5 O14804 1/20 0.44
GFER P55789 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PNMT P11086 1/20 0.43

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
SCHEMBL8414986 0.91 ACACB (0.57) PDE7AFFAR1CYP19A1GLASMN1; SMN2
SCHEMBL2511362 0.90 PDE7A (0.55) PDE7AFFAR1GLASMN1; SMN2ACACB
SCHEMBL8417842 0.87 PDE7A (0.52) PDE7AFFAR1GLASMN1; SMN2ACACB
SCHEMBL4318630 0.83 PDE7A (0.63) PDE7ASMN1; SMN2MAOAMAOBGFER
SCHEMBL13742641 0.82 FFAR1 (0.56) PDE7AFFAR1SMN1; SMN2ACACB
SCHEMBL554810 0.80 MAOA (0.61) PDE7AFFAR1SMN1; SMN2MAOAMAOB
SCHEMBL8904604 0.80 PDE7A (0.59) PDE7ASMN1; SMN2MAOAMAOBGFER
SCHEMBL11118950 0.80 SMN1; SMN2 (0.49) PDE7AFFAR1GLASMN1; SMN2ACACB
SCHEMBL21186209 0.77 PDE7A (0.56) PDE7ASMN1; SMN2MAOAMAOBGFER
SCHEMBL31264488 0.77 PDE7A (0.56) PDE7ASMN1; SMN2MAOAMAOBGFER

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-0604885-B1 Liquid crystal display device HOECHST AG (DE) 1997-12-10 EP disclosed
US-5437813-A A thin alignment layer comprising an aromatic polyamide-polysiloxane block homo- or copolymer with different content of polysiloxane to adjust optical pretilt angle HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-01 US disclosed
EP-0604885-A1 Liquid crystal display device HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-06 EP disclosed