SCHEMBL8186882

SCHEMBL8186882

CCCCCCCCCCOc1ccc(/C=C2/SC(=O)NC2=N)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.64
▸ PIM2 Q9P1W9 2/20 0.64
▸ CISD1 Q9NZ45 2/20 0.59
▸ HPGD P15428 12/20 0.54
▸ MEN1 O00255 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ HRH3 Q9Y5N1 1/20 0.50
▸ BRD4 O60885 1/20 0.49
▸ PTGES O14684 1/20 0.48

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
SCHEMBL8186886 1.00 PIM1 (0.64) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181612 0.99 PIM1 (0.66) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181608 0.99 PIM1 (0.66) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8188212 0.85 HPGD (0.74) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8188211 0.85 HPGD (0.74) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181424 0.84 PIM1 (0.67) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181421 0.84 PIM1 (0.67) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181806 0.84 PIM1 (0.67) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181804 0.84 PIM1 (0.67) PIM1PIM2CISD1HPGDMEN1
SCHEMBL8181583 0.83 PIM1 (0.58) PIM1PIM2CISD1HPGDMEN1

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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