SCHEMBL8181583

SCHEMBL8181583

N=C1NC(=O)S/C1=C\c1ccc(OCCO)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.58
▸ PIM2 Q9P1W9 2/20 0.58
▸ GPR35 Q9HC97 1/20 0.53
▸ HPGD P15428 11/20 0.53
▸ CISD1 Q9NZ45 2/20 0.53
▸ BRD4 O60885 1/20 0.52
▸ HRH3 Q9Y5N1 1/20 0.50
▸ MAOA P21397 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ PTGS2 P35354 1/20 0.50

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
SCHEMBL8181584 1.00 PIM1 (0.58) PIM1PIM2GPR35HPGDCISD1
SCHEMBL9803952 0.87 PIM1 (0.74) PIM1PIM2GPR35HPGDCISD1
SCHEMBL9803954 0.87 PIM1 (0.74) PIM1PIM2GPR35HPGDCISD1
SCHEMBL8181608 0.84 PIM1 (0.66) PIM1PIM2HPGDCISD1BRD4
SCHEMBL8181612 0.84 PIM1 (0.66) PIM1PIM2HPGDCISD1BRD4
SCHEMBL8186882 0.83 PIM1 (0.64) PIM1PIM2HPGDCISD1BRD4
SCHEMBL8186886 0.83 PIM1 (0.64) PIM1PIM2HPGDCISD1BRD4
SCHEMBL8182040 0.83 POLB (0.65) PIM1PIM2GPR35HPGDCISD1
SCHEMBL8182042 0.83 POLB (0.65) PIM1PIM2GPR35HPGDCISD1
SCHEMBL9803959 0.81 CSNK2A2 (0.62) PIM1PIM2GPR35HPGDCISD1

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
WO-2000018746-A1 THIAZOLIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS ROCHE DIAGNOSTICS GMBH (DE) 2000-04-06 — — WO disclosed
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