SCHEMBL5817592

SCHEMBL5817592

C[S+]([O-])c1nccc(-c2scnc2-c2ccccc2F)n1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 1/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ DBF4 Q9UBU7 1/20 0.35
▸ MPL P40238 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ CDK4 P11802 1/20 0.32
▸ CDK2 P24941 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ MBNL1 Q9NR56 1/20 0.32
▸ NPC1 O15118 3/20 0.31
▸ RAB9A P51151 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ PTGS2 P35354 1/20 0.30
▸ ALDH1A2 O94788 1/20 0.30

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
SCHEMBL5818004 0.81 MEN1 (0.33) TGFBR1CDK2MAPK14NPC1RAB9A
SCHEMBL5815412 0.79 KMO (0.38) CDK4CDK2ADORA2AALDH1A2
SCHEMBL5813449 0.78 KDM4E (0.41) TGFBR1CDC7DBF4MPLPIM1
SCHEMBL5812111 0.76 KCNH2 (0.39) TGFBR1CDC7DBF4NPC1RAB9A
SCHEMBL5819177 0.75 MAPK14 (0.38) MAPK14
SCHEMBL5817042 0.74 RORB (0.38) TGFBR1CDK4CDK2MAPK14ADORA2A
SCHEMBL5815206 0.74 KMO (0.41) PIM1MAPK14ADORA2A
SCHEMBL5813457 0.74 NPC1 (0.39) NPC1RAB9A
SCHEMBL5819868 0.74 CDC7 (0.38) TGFBR1CDC7DBF4MPLPIM1
SCHEMBL5819043 0.72 MAPK8 (0.43) CDC7PIM1CDK4CDK2MAPK14

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
WO-2006137658-A1 NEW SUBSTITUTED 1,3-THIAZOLE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVING IMMUNOSUPPRESSION AND INFLAMMATION INHIBITORY ACITIVITY, INTERMEDIATE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, A PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DONGBU HITEK CO., LTD. (KR) 2006-12-28 — — WO claimed
WO-2006137658-A1 NEW SUBSTITUTED 1,3-THIAZOLE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVING IMMUNOSUPPRESSION AND INFLAMMATION INHIBITORY ACITIVITY, INTERMEDIATE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, A PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DONGBU HITEK CO., LTD. (KR) 2006-12-28 — — WO disclosed
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