SCHEMBL80964

SCHEMBL80964

O=c1ccsn1C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 2/20 0.39
GSK3B P49841 2/20 0.39
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KMT2A Q03164 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MPI P34949 1/20 0.36
MAPT P10636 1/20 0.35
G6PD P11413 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
EP300 Q09472 1/20 0.34
KAT2B Q92831 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34

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
SCHEMBL8346184 0.98 MPI (0.36) GSK3AGSK3BALDH1A1SMN1; SMN2KMT2A
SCHEMBL1533679 0.80 GRM5 (0.40) ALDH1A1CYP3A4MAPTG6PDPKM
SCHEMBL9130580 0.65 GSK3A (0.37) GSK3AGSK3BALDH1A1SMN1; SMN2KMT2A
SCHEMBL9008472 0.65 GSK3A (0.40) GSK3AGSK3BALDH1A1SMN1; SMN2KMT2A
SCHEMBL9576566 0.65 GSK3A (0.37) GSK3AGSK3BALDH1A1SMN1; SMN2KMT2A
SCHEMBL10261468 0.63 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KMT2ACYP3A4CYP2C9
SCHEMBL10260482 0.63 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KMT2ACYP3A4CYP2C9
SCHEMBL8621565 0.62 MPI (0.57) ALDH1A1SMN1; SMN2MPIMAPTG6PD
SCHEMBL9133072 0.62 ALDH1A1 (0.44) ALDH1A1KMT2ACYP3A4MAPTG6PD
SCHEMBL12511989 0.61 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2KMT2ACYP3A4CYP2C9

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1362018-A Halocyanoacetamide antimicrobial composition ROHM & HAAS (US) 2002-08-07 CN claimed
US-4900736-A Salts of alkyl-2-benzimidazole-carbamate and fungicidal compositions thereof suitable for paints and plaster SCHULKE MAYR, GMBH (DE) 1990-02-13 US claimed
US-4686239-A WITHIN PORES OF THERMOPLASTIC POWDER; MORTON THIOKOL, INC. (US) 1987-08-11 US claimed
US-4663359-A POROUS THERMOPLASTIC, NON-DUSTING MORTON THIOKOL, INC. (US) 1987-05-05 US claimed
US-4661528-A HIGH CONCENTRATION, POROUS THERMOPLASTIC POWDER, NON-DUSTING AND FREE-FLOWING MORTON THIOKOL, INC. (US) 1987-04-28 US claimed
CN-117836280-A Preparation method of 4-bromo-isothiazolinone derivative and 4-bromo-isothiazolinone derivative 奥加诺株式会社 2024-04-05 CN disclosed
WO-2023032654-A1 PRODUCTION METHOD FOR 4-BROMOISOTHIAZOLINONE DERIVATIVE AND 4-BROMOISOTHIAZOLINONE DERIVATIVE オルガノ株式会社 2023-03-09 WO disclosed
US-20160290036-A1 HEAT-SHIELDING MATERIAL AND WINDOW GLASS FUJIFILM CORPORATION (JP) 2016-10-06 US disclosed
US-20160290036-A1 HEAT-SHIELDING MATERIAL AND WINDOW GLASS FUJIFILM CORPORATION (JP) 2016-10-06 US disclosed
US-8129308-B2 Thermal transfer image-receiving sheet and surface condition improver FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-8129308-B2 Thermal transfer image-receiving sheet and surface condition improver FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-20090087552-A1 METHOD OF PRODUCING HEAT-SENSITIVE TRANSFER IMAGE-RECEIVING SHEET FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-4279762-A Cutting oils containing 3-isothiazolones as biocides ROHM AND HAAS COMPANY (US) 1981-07-21 US disclosed
US-4265899-A FUNGICIDES, BACTERICIDES ROHM AND HAAS COMPANY (US) 1981-05-05 US disclosed
US-4252694-A MICROBIOCIDES ROHM AND HAAS COMPANY (US) 1981-02-24 US disclosed
US-4243403-A BACTERICIDES, ACRYLIC POLYMERS, FUNGICIDES ROHM AND HAAS COMPANY (US) 1981-01-06 US disclosed
US-4241214-A BACTERICIDE, FUNGICIDE AND ALGAECIDE ROHM AND HAAS COMPANY (US) 1980-12-23 US disclosed
US-4150026-A BACTERICIDES, FUNGICIDES, ALGICIDES ROHM AND HAAS COMPANY (US) 1979-04-17 US disclosed
US-4105431-A BACTERICIDES, FUNGICIDES, ALGICIDES ROHM AND HAAS COMPANY (US) 1978-08-08 US disclosed
US-4062946-A 3-ISOTHIAZOLONES ROHM AND HAAS COMPANY (US) 1977-12-13 US disclosed