SCHEMBL8614425

SCHEMBL8614425

CCCCSc1ccccn1.O=C1NC(=O)C(=Cc2ccc(Cl)cc2)S1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 6/20 0.53
▸ PIM2 Q9P1W9 6/20 0.53
▸ HPGD P15428 7/20 0.49
▸ NPC1 O15118 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ PPARG P37231 1/20 0.46
▸ CNR1 P21554 1/20 0.45
▸ PIM3 Q86V86 1/20 0.45
▸ IGF1R P08069 1/20 0.44
▸ CISD1 Q9NZ45 1/20 0.44
▸ MYC P01106 1/20 0.44
▸ NAT1 P18440 1/20 0.44
▸ MAX P61244 1/20 0.44
▸ MGAM O43451 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SI P14410 1/20 0.43
▸ MGAM2 Q2M2H8 1/20 0.43

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
SCHEMBL8614423 0.89 CSNK2A2 (0.40) PIM1PIM2HPGDNPC1HTT
SCHEMBL8616364 0.88 PIM1 (0.57) PIM1PIM2HPGDNPC1RAB9A
SCHEMBL8618308 0.88 MTOR (0.47) PIM1PIM2HPGDPPARGPIM3
SCHEMBL8640744 0.87 HPGD (0.47) PIM1PIM2HPGDNPC1HTT
SCHEMBL8617896 0.87 GSK3B (0.61) PIM1PIM2HPGDNPC1HTT
SCHEMBL8617338 0.84 GSK3B (0.57) PIM1PIM2HPGDNPC1HTT
SCHEMBL8619012 0.83 PTGS2 (0.60) PIM1PIM2HPGDPPARGPIM3
SCHEMBL8620558 0.81 CRHBP (0.60) PIM1PIM2NPC1RAB9ACISD1
SCHEMBL8616362 0.77 CLK1 (0.58) PIM1PIM2HPGDNPC1RAB9A
SCHEMBL8618302 0.77 NPC1 (0.37) HPGDNPC1RAB9APPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5767121-A ANTIINFLAMMATORY AND -ARTHRITIC AGENTS; ANTIPYRETICS; ANALGESICS; ADHESION PROTEIN EXPRESSION AND CYCLOXYGENASE AND 5-LIPOXYGENASE INHIBITORS; IMMUNOSUPPRESSANTS AND -MODULATORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-16 — — US disclosed
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