SCHEMBL4667034

SCHEMBL4667034

c1ccc2c(c1)CC(NC1=NCCS1)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 2/20 0.44
TAAR1 Q96RJ0 1/20 0.44
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
TP53 P04637 2/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ATM Q13315 1/20 0.38
MITF O75030 1/20 0.38
PKM P14618 1/20 0.38
KLF5 Q13887 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL12895145 0.74 GRIN1 (0.39) POLBSMN1; SMN2ALDH1A1GAALMNA
SCHEMBL12253328 0.74 POLB (0.42) POLBSMN1; SMN2ALDH1A1GAALMNA
SCHEMBL3750599 0.73 ATM (0.43) POLBSMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL1993959 0.73 LMNA (0.49) POLBLMNA
SCHEMBL2797750 0.70 LMNA (0.43) POLBSMN1; SMN2ALDH1A1GAALMNA
SCHEMBL11420042 0.69 POLB (0.50) POLBSMN1; SMN2ALDH1A1GAALMNA
SCHEMBL3756960 0.69 CA1 (0.54) SMN1; SMN2GAARAB9ANPC1TP53
SCHEMBL7354403 0.67 POLB (1.00) POLBSMN1; SMN2ALDH1A1LMNATAAR1
SCHEMBL12567258 0.66 RAB9A (0.42) POLBSMN1; SMN2LMNATAAR1RAB9A
SCHEMBL9658772 0.66 POLB (0.70) POLBSMN1; SMN2ALDH1A1GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4861789-A Dihydro-indene-amine-dihydrooxazoles BEECHAM GROUP PLC (GB) 1989-08-29 US claimed
EP-0251453-A2 Substituted amino-dihydrooxazoles, -thiazoles and -imidazoles, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-01-07 EP claimed
WO-2008135181-A2 INSECTICIDAL SUBSTITUTED 2-AMINOINDANES BAYER CROPSCIENCE AG (DE) 2008-11-13 WO disclosed
WO-2008135181-A2 INSECTICIDAL SUBSTITUTED 2-AMINOINDANES BAYER CROPSCIENCE AG (DE) 2008-11-13 WO disclosed
EP-1988080-A1 Insecticidal substituted 2-aminoindanes Bayer CropScience AG (DE) 2008-11-05 EP disclosed
EP-1988080-A1 Insecticidal substituted 2-aminoindanes Bayer CropScience AG (DE) 2008-11-05 EP disclosed
US-4861789-A Dihydro-indene-amine-dihydrooxazoles BEECHAM GROUP PLC (GB) 1989-08-29 US disclosed
EP-0251453-A2 Substituted amino-dihydrooxazoles, -thiazoles and -imidazoles, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-01-07 EP disclosed