SCHEMBL11048480

SCHEMBL11048480

Nc1cc(Cl)c2cc3ccccc3nc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.55
KMT2A Q03164 6/20 0.53
ALDH1A1 P00352 5/20 0.53
GLA P06280 4/20 0.53
KDM4E B2RXH2 4/20 0.53
HPGD P15428 3/20 0.53
GAA P10253 3/20 0.53
RAB9A P51151 2/20 0.53
NPC1 O15118 2/20 0.53
LMNA P02545 2/20 0.53
POLB P06746 2/20 0.53
PTBP1 P26599 1/20 0.53
RCE1 Q9Y256 1/20 0.53
MAPT P10636 4/20 0.50
ACHE P22303 3/20 0.48
IDO1 P14902 1/20 0.44
MEN1 O00255 3/20 0.40
MAOA P21397 3/20 0.39
CHRM2 P08172 2/20 0.39
ADRA2A P08913 2/20 0.39

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
SCHEMBL27961721 0.79 MAPT (0.59) KMT2AALDH1A1GLAKDM4EHPGD
SCHEMBL29097354 0.79 HTR3A (0.55) HTR3AKMT2AALDH1A1GLAKDM4E
SCHEMBL4160733 0.77 ALDH1A1 (0.60) HTR3AKMT2AALDH1A1GLAKDM4E
SCHEMBL28335934 0.75 MAPT (0.54) KMT2AALDH1A1GLAKDM4EHPGD
SCHEMBL11715187 0.72 CYP2A6 (0.50) ALDH1A1HPGDGAAMAPTCASP1
Proflavine SCHEMBL3864747 0.71 HTR3A (1.00) HTR3AKMT2AALDH1A1GLAKDM4E
SCHEMBL29911350 0.71 TLR8 (0.53) HTR3AKMT2AALDH1A1GLAKDM4E
SCHEMBL1229699 0.71 HTR3A (1.00) HTR3AKMT2AALDH1A1GLAKDM4E
SCHEMBL3300463 0.71 TLR8 (0.53) HTR3AKMT2AALDH1A1GLAKDM4E
SCHEMBL17141873 0.70 ALDH1A1 (0.61) HTR3AKMT2AALDH1A1GLAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4465721-A FROM DIHYDRIC PHENOL WITH CARBON MONOXIDE AND HYDROGEN MCALISTER ROY E 1984-08-14 US disclosed
US-4414364-A ENDCAPPING WITH A HALOHYDROCARBON OR A TRIALKYL SILICON HALIDE MCALISTER ROY E 1983-11-08 US disclosed
US-4350663-A ENDCAPPING POLYCARBONATES WITH GASEOUS REACTANT TO PROVIDE STRESS CORROSION RESISTANCE MCALISTER ROY E 1982-09-21 US disclosed
WO-1982001554-A1 POLYCARBONATES STABILIZED BY HALOHYDROCARBON,HALOCARBON OR SILANE GROUPS MCALISTER ROY E 1982-05-13 WO disclosed
EP-0027144-A4 POLYCARBONATES STABILIZED BY HALOHYDROCARBON, HALOCARBON OR SILANE GROUPS. MCALISTER ROY E 1981-05-19 EP disclosed
EP-0027144-A1 POLYCARBONATES STABILIZED BY HALOHYDROCARBON, HALOCARBON OR SILANE GROUPS McALISTER, Roy Edward (US) 1981-04-22 EP disclosed
US-4243779-A FLUORESCENCE, PHOTOSTABILITY MCALISTER ROY E 1981-01-06 US disclosed
WO-1980002290-A1 POLYCARBONATES STABILIZED BY HALOHYDROCARBON,HALOCARBON OR SILANE GROUPS MCALISTER R 1980-10-30 WO disclosed