SCHEMBL8186778

SCHEMBL8186778

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

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.74
PIM2 Q9P1W9 1/20 0.74
CRHBP P24387 1/20 0.67
CRHR2 Q13324 1/20 0.67
TDP1 Q9NUW8 14/20 0.65
PNP P00491 2/20 0.65
MEN1 O00255 2/20 0.59
ALDH1A1 P00352 2/20 0.59
LMNA P02545 2/20 0.59
MAPT P10636 2/20 0.59
HPGD P15428 2/20 0.59
KMT2A Q03164 2/20 0.59
POLB P06746 1/20 0.59
MAPK1 P28482 1/20 0.59
RAB9A P51151 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
RECQL P46063 1/20 0.58
GSK3B P49841 1/20 0.56

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
SCHEMBL8186777 1.00 PIM1 (0.74) PIM1PIM2CRHBPCRHR2TDP1
SCHEMBL24991948 0.86 CRHBP (0.73) PIM1PIM2CRHBPCRHR2TDP1
SCHEMBL2544392 0.85 PIM1 (1.00) PIM1PIM2CRHBPCRHR2TDP1
SCHEMBL1248777 0.85 PIM1 (1.00) PIM1PIM2CRHBPCRHR2TDP1
SCHEMBL1248775 0.85 PIM1 (1.00) PIM1PIM2CRHBPCRHR2TDP1
SCHEMBL24991983 0.82 TDP1 (0.58) PIM1PIM2CRHBPCRHR2TDP1
SCHEMBL1249935 0.80 CRHBP (1.00) PIM1PIM2CRHBPCRHR2MEN1
SCHEMBL194557 0.80 CRHBP (1.00) PIM1PIM2CRHBPCRHR2MEN1
SCHEMBL194558 0.80 CRHBP (1.00) PIM1PIM2CRHBPCRHR2MEN1
SCHEMBL14860905 0.79 TDP1 (1.00) TDP1PNPMEN1ALDH1A1LMNA

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