SCHEMBL6289587

SCHEMBL6289587

CCNC(=O)NCC(CO)(CO)CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
GAA P10253 1/20 0.33
EPHX2 P34913 1/20 0.33
EPHX1 P07099 5/20 0.32
KMT2A Q03164 2/20 0.32
MCL1 Q07820 1/20 0.31
NOS2 P35228 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
MTNR1A P48039 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
SCHEMBL6284467 0.91 ALDH1A1 (0.32) CHRM2CHRM1CHRM3SMN1; SMN2ALDH1A1
SCHEMBL6286877 0.80 ALDH1A1 (0.33) CHRM2CHRM1CHRM3SMN1; SMN2ALDH1A1
SCHEMBL622102 0.80 SMN1; SMN2 (0.34) CHRM2CHRM1CHRM3SMN1; SMN2ALDH1A1
SCHEMBL6285467 0.80 ALDH1A1 (0.37) CHRM2CHRM1CHRM3SMN1; SMN2ALDH1A1
SCHEMBL6289634 0.80 MCL1 (0.34) CHRM2CHRM1CHRM3SMN1; SMN2ALDH1A1
SCHEMBL6287612 0.79 EPHX1 (0.59) MMP1MMP2EPHX1
SCHEMBL6290232 0.79 HSD17B10 (0.34) SMN1; SMN2ALDH1A1KMT2AMAPTMTNR1A
SCHEMBL320068 0.77
SCHEMBL28293734 0.77 MMP1 (0.48) SMN1; SMN2ALDH1A1MMP1MMP2MMP3
SCHEMBL6280382 0.77 ALDH1A1 (0.35) CHRM2CHRM1CHRM3SMN1; SMN2ALDH1A1

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