SCHEMBL11534703

SCHEMBL11534703

NC(=S)Nc1c(Br)cccc1Br

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.46
▸ TP53 P04637 1/20 0.46
▸ TYR P14679 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ TAS2R38 P59533 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ CYP1A2 P05177 2/20 0.42
▸ GAA P10253 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CYP3A4 P08684 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX12 P18054 1/20 0.38

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
SCHEMBL10911325 0.86 L3MBTL1 (0.52) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL11083418 0.81 L3MBTL1 (0.46) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL5450263 0.77 GAA (0.46) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL11882025 0.77 L3MBTL1 (0.41) L3MBTL1KMT2AGAAKDM4EMEN1
SCHEMBL8436453 0.77 L3MBTL1 (0.71) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL13846512 0.76 GAA (0.44) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL31022673 0.76 L3MBTL1 (1.00) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL2357864 0.76 L3MBTL1 (1.00) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL30356255 0.74 KMT2A (0.55) L3MBTL1KMT2AALDH1A1TP53TYR
SCHEMBL30356290 0.74 KMT2A (0.50) L3MBTL1KMT2AALDH1A1TP53TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110590785-B Aminothiazole compound, preparation method thereof and application of aminothiazole compound in resisting enterovirus 71 武汉大学 2021-02-02 — — CN disclosed
CN-110590785-A Aminothiazole compound, preparation method thereof and application of aminothiazole compound in resisting enterovirus 71 武汉大学 2019-12-20 — — CN disclosed
US-4169154-A Method of treating depression with thiourea derivatives HOFFMANN-LA ROCHE INC. (US) 1979-09-25 — — US disclosed
US-4150138-A Method of reducing blood pressure with thiourea derivatives and guanidine derivatives HOFFMANN-LA ROCHE INC. (US) 1979-04-17 — — US disclosed
US-4113776-A HYPOTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1978-09-12 — — US disclosed
US-4096276-A Thiourea derivatives for treating hypertension HOFFMANN-LA ROCHE INC. (US) 1978-06-20 — — US disclosed
US-4066695-A ANTIHYPERTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1978-01-03 — — US disclosed
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