SCHEMBL28732273

SCHEMBL28732273

CCCCCCCCCC(N=C=O)C(C)N=C=O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
OPRM1 P35372 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
GPR84 Q9NQS5 3/20 0.34
FDPS P14324 3/20 0.34
CA1 P00915 2/20 0.34
SPHK1 Q9NYA1 1/20 0.34
FFAR1 O14842 1/20 0.34
TP53 P04637 1/20 0.33
LMNA P02545 1/20 0.33
LCK P06239 1/20 0.33
PPARD Q03181 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33

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
SCHEMBL27186002 0.92 TSHR (0.30) FDPS
SCHEMBL7031315 0.88 MAPT (0.42) MAPTADH1BADH1CADH1AADH4
SCHEMBL10439694 0.88 MAPT (0.42) MAPTADH1BADH1CADH1AADH4
SCHEMBL14628498 0.86 ACE2 (0.40) MAPTADH1BADH1CADH1AADH4
SCHEMBL27185976 0.84 TRPA1 (0.30)
SCHEMBL28666090 0.83 MAPT (0.36) MAPTADH1BADH1CADH1AADH4
SCHEMBL27856727 0.82 MAPT (0.38) MAPTADH1BADH1CADH1AADH4
SCHEMBL9356856 0.78 MAPT (0.41) MAPTADH1BADH1CADH1AADH4
SCHEMBL17027536 0.78 MAPT (0.41) MAPTADH1BADH1CADH1AADH4
SCHEMBL17027509 0.78 MAPT (0.41) MAPTADH1BADH1CADH1AADH4

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
CN-109312043-B Contact adhesive product based on polyurethane urea, production thereof and corresponding contact adhesive 科思创德国股份有限公司 2022-05-10 CN disclosed
CN-109312044-B Adhesive based on specific polyurethane urea, preparation and use thereof 科思创德国股份有限公司 2022-03-25 CN disclosed