SCHEMBL9872560

SCHEMBL9872560

CC1NC(=N)SC1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
ESR1 P03372 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL8977802 0.77 ALDH1A1 (0.47) SLC6A2ADRA1AHTR2BSLC6A3ALDH1A1
SCHEMBL9870950 0.77 MEN1 (0.38) ALDH1A1HPGDCYP1A2CYP2D6CYP2C19
SCHEMBL9635178 0.69 TNKS2 (0.42) ALDH1A1HPGDHSD17B10TSHRKDM4E
SCHEMBL8188471 0.63 GLA (0.33) HTR2BHPGDTSHRKDM4ECHRNA7
SCHEMBL11573778 0.61 TSHR (0.39) SLC6A2ADRA1AHTR2BSLC6A3CYP1A2
SCHEMBL29025323 0.60 SLC6A2 (0.47) SLC6A2ADRA1AHTR2BSLC6A3ALDH1A1
SCHEMBL27686420 0.60 TSHR (0.42) ALDH1A1HPGDHSD17B10TSHRMEN1
SCHEMBL23465393 0.60 CHRNA7 (0.54) SLC6A2ADRA1AHTR2BSLC6A3ALDH1A1
SCHEMBL18244886 0.60 CHRNA7 (0.54) SLC6A2ADRA1AHTR2BSLC6A3ALDH1A1
SCHEMBL18360030 0.60 CHRNA7 (0.54) SLC6A2ADRA1AHTR2BSLC6A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4996208-A Pesticidal thiazolopyrimidine derivatives BAYER AKTIENGESELLSCHAFT (DE) 1991-02-26 US disclosed
EP-0348746-A2 Thiazolopyrimidine derivatives, process for their preparation and their use as pest control agents BAYER AG (DE) 1990-01-03 EP disclosed