SCHEMBL6290232

SCHEMBL6290232

CNC(=O)NCC(CO)(CO)CO

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.34
MTNR1A P48039 1/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL6290265 0.89 HSD17B10 (0.32) HSD17B10KEAP1NFE2L2
SCHEMBL6286732 0.81 HSD17B10 (0.34) HSD17B10KEAP1NFE2L2KMT2A
SCHEMBL6289587 0.79 CHRM2 (0.35) MTNR1AALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL6289597 0.79 HSD17B10 (0.33) HSD17B10KEAP1NFE2L2ADRB2ADRB1
SCHEMBL6284942 0.79 HSD17B10 (0.35) HSD17B10KEAP1NFE2L2ALDH1A1SMN1; SMN2
SCHEMBL6284472 0.76 HSD17B10 (0.32) HSD17B10KEAP1NFE2L2
SCHEMBL6289690 0.76 HSD17B10 (0.32) HSD17B10KEAP1NFE2L2
SCHEMBL9278494 0.75 HSD17B10 (0.36) HSD17B10MTNR1AKEAP1NFE2L2ALDH1A1
SCHEMBL969296 0.73 HSD17B10 (0.35) HSD17B10MTNR1AKEAP1NFE2L2ALDH1A1
SCHEMBL965910 0.73 SMN1; SMN2 (0.43) HSD17B10KEAP1NFE2L2SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916854-B2 Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20040097642-A1 Unsaturated compounds containing carbamate terminal groups or urea terminal groups BASF AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed