SCHEMBL5710968

SCHEMBL5710968

OCCCN1c2ccccc2N(CCCO)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MAPK1 P28482 3/20 0.53
TP53 P04637 3/20 0.53
HTR2A P28223 5/20 0.49
SLC6A2 P23975 5/20 0.49
CHRM2 P08172 4/20 0.49
CHRM1 P11229 4/20 0.49
DRD2 P14416 4/20 0.49
ADRA2B P18089 4/20 0.49
ADRA2C P18825 4/20 0.49
SLC6A4 P31645 4/20 0.49
ADRA1A P35348 4/20 0.49
HRH1 P35367 4/20 0.49
DRD3 P35462 4/20 0.49
KCNH2 Q12809 4/20 0.49
HTR1A P08908 3/20 0.49
DRD1 P21728 3/20 0.49
OPRM1 P35372 3/20 0.49
CACNA1B Q00975 3/20 0.49
SLC6A3 Q01959 3/20 0.49

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
SCHEMBL30634566 1.00 ALDH1A1 (0.53) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL909935 1.00 ALDH1A1 (0.53) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL30634565 0.91 ALDH1A1 (0.47) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL5711036 0.91 ALDH1A1 (0.47) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL5711013 0.91 ALDH1A1 (0.47) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL5711008 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL5711037 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL5711025 0.84 HTR2A (0.47) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL29833637 0.84 HTR2A (0.47) ALDH1A1MAPK1TP53HTR2ASLC6A2
SCHEMBL6961973 0.83 HTR2A (0.68) ALDH1A1MAPK1TP53HTR2ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230266631-A1 MULTILAYER LOW CURRENT ELECTRO-OPTIC ASSEMBLY GENTEX CORPORATION (US) 2023-08-24 US disclosed
WO-2023156971-A1 MULTILAYER LOW CURRENT ELECTRO-OPTIC ASSEMBLY GENTEX CORPORATION (US) 2023-08-24 WO disclosed
EP-1027397-B1 ELECTROCHROME POLYMER SYSTEMS BAYER INNOVATION GMBH (DE) 2006-10-18 EP disclosed
US-6569361-B1 Polycondensation or polyaddition of electrochromic monomers are used in devices for variable transparency BAYER AKTIENGESELLSCHAFT (DE) 2003-05-27 US disclosed
EP-1027397-A1 ELECTROCHROME POLYMER SYSTEMS Bayer Aktiengesellschaft (DE) 2000-08-16 EP disclosed
WO-1999002621-A1 ELECTROCHROME POLYMER SYSTEMS BAYER AKTIENGESELLSCHAFT (DE) 1999-01-21 WO disclosed