SCHEMBL16628825

SCHEMBL16628825

CCCCN(C=CC(=O)OCC)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.43
ATM Q13315 1/20 0.43
MAPT P10636 4/20 0.40
ALDH1A1 P00352 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA9 Q16790 2/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
RAB9A P51151 1/20 0.34
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
TTR P02766 1/20 0.33
DPP4 P27487 1/20 0.33
ALOX15 P16050 1/20 0.32
LMNA P02545 1/20 0.31
MDM2 Q00987 1/20 0.31

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
SCHEMBL2007137 0.79 CA1 (0.35) ATMMAPTALDH1A1CA12CA1
SCHEMBL28831576 0.73 HCAR2 (0.50) HCAR2ATMMAPTALDH1A1CA12
SCHEMBL11492347 0.71 TSHR (0.41) RAB9AHPGDTSHR
SCHEMBL8087451 0.71 TSHR (0.41) RAB9AHPGDTSHR
SCHEMBL5610345 0.71 APEX1 (0.31) HCAR2ATMALDH1A1CA12CA1
SCHEMBL9016875 0.71 APEX1 (0.34) ALDH1A1
SCHEMBL8354202 0.70 HCAR2 (0.56) HCAR2ATMMAPTALDH1A1CA12
SCHEMBL286112 0.70 HCAR2 (0.56) HCAR2ATMMAPTALDH1A1CA12
SCHEMBL286141 0.70 HCAR2 (0.56) HCAR2ATMMAPTALDH1A1CA12
SCHEMBL4346470 0.70 CA12 (0.50) ALDH1A1CA12CA1CA9CA2

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
EP-1910428-B1 COPOLYMERS CONTAINING LATERAL CARBAMATE GROUPS AND GROUPS ACTIVATED BY MEANS OF ACTINIC RADIATION, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF BASF COATINGS GMBH (DE) 2015-04-15 EP disclosed