SCHEMBL11366303

SCHEMBL11366303

CCCc1nc(CCl)cs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 2/20 0.47
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
DRD2 P14416 1/20 0.43
HTR2A P28223 1/20 0.43
HRH1 P35367 1/20 0.43
ALDH1A1 P00352 9/20 0.42
TDP1 Q9NUW8 7/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 4/20 0.41
GFER P55789 3/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 6/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 4/20 0.39
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35

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
Hydrochloric Acid SCHEMBL11624078 0.98 RAB9A (0.47) SLC6A3RAB9ANPC1POLBGAA
SCHEMBL27667132 0.89 SLC6A3 (0.49) SLC6A3RAB9ANPC1POLBGAA
Hydrochloric Acid SCHEMBL7179537 0.85 RAB9A (0.44) SLC6A3RAB9ANPC1POLBGAA
SCHEMBL11926805 0.83 SLC6A3 (0.49) SLC6A3RAB9ANPC1POLBGAA
SCHEMBL1053330 0.83
Hydrochloric Acid SCHEMBL7094518 0.82 RAB9A (0.54) SLC6A3RAB9ANPC1POLBGAA
SCHEMBL11318891 0.81
SCHEMBL442405 0.80 SLC6A3 (0.47) SLC6A3DRD2HTR2AHRH1
SCHEMBL127291 0.80 SLC6A3 (0.47) SLC6A3DRD2HTR2AHRH1
SCHEMBL7009281 0.80 SLC6A3 (0.47) SLC6A3DRD2HTR2AHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109054648-A Serosity combination for chemically mechanical polishing LTCAM有限公司 2018-12-21 CN claimed
CN-109054648-A Serosity combination for chemically mechanical polishing LTCAM有限公司 2018-12-21 CN disclosed
US-4307105-A FUNGICIDES AND BACTERICIDES E. R. SQUIBB & SONS, INC. (US) 1981-12-22 US disclosed
US-4123529-A TREATMENT OF ASTHMA LILLY INDUSTRIES LIMITED (GB) 1978-10-31 US disclosed