SCHEMBL8179068

SCHEMBL8179068

CC(C)c1ccc(C=C2SC(=S)NC2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 3/20 1.00
▸ MAX P61244 3/20 1.00
▸ PIM1 P11309 1/20 0.77
▸ NAT1 P18440 6/20 0.70
▸ MTOR P42345 1/20 0.66
▸ CISD1 Q9NZ45 3/20 0.66
▸ NPC1 O15118 1/20 0.65
▸ RAB9A P51151 1/20 0.65
▸ CRHBP P24387 1/20 0.65
▸ CRHR2 Q13324 1/20 0.65
▸ CSNK2A2 P19784 1/20 0.65
▸ CLK1 P49759 1/20 0.65
▸ CSNK2B P67870 1/20 0.65
▸ CSNK2A1 P68400 1/20 0.65
▸ DYRK1A Q13627 1/20 0.65
▸ DYRK1B Q9Y463 1/20 0.65
▸ CA2 P00918 1/20 0.65
▸ EPHX1 P07099 1/20 0.65
▸ MAOA P21397 1/20 0.61

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
SCHEMBL20816056 1.00 MYC (1.00) MYCMAXPIM1NAT1MTOR
SCHEMBL8179067 1.00 MYC (1.00) MYCMAXPIM1NAT1MTOR
SCHEMBL2543142 0.87 PIM1 (1.00) MYCMAXPIM1CISD1NPC1
SCHEMBL2543140 0.87 PIM1 (1.00) MYCMAXPIM1CISD1NPC1
SCHEMBL2543138 0.87 PIM1 (1.00) MYCMAXPIM1CISD1NPC1
SCHEMBL4058338 0.86 MMP3 (0.73) MYCMAXPIM1NPC1RAB9A
SCHEMBL4057818 0.86 MYC (0.73) MYCMAXPIM1NAT1MTOR
SCHEMBL4058340 0.86 MMP3 (0.73) MYCMAXPIM1NPC1RAB9A
SCHEMBL4055287 0.86 MMP3 (0.73) MYCMAXPIM1NPC1RAB9A
SCHEMBL4057820 0.86 MYC (0.73) MYCMAXPIM1NAT1MTOR

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-20190085404-A1 METHODS OF IDENTIFYING AND TREATING IMMUNE CHECKPOINT INHIBITOR-RESPONSIVE NEOPLASMS AND CELLS, TRANSGENIC ANIMALS AND KITS FOR USE THEREIN THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2019-03-21 — — US disclosed
WO-2000018748-A1 RHODANINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS ROCHE DIAGNOSTICS GMBH (DE) 2000-04-06 — — WO disclosed
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