SCHEMBL7103711

SCHEMBL7103711

CC(C)(N)CN(CCO)CCO

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.34
MAPK1 P28482 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ARG1 P05089 1/20 0.30
ARG2 P78540 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
SCHEMBL30814712 0.88 CYP1A2 (0.41) MAPTHPGDMAPK1KDM4EALDH1A1
SCHEMBL21618434 0.82 MAPT (0.33) MAPTHPGDMAPK1KDM4EALDH1A1
Trolamine SCHEMBL4518758 0.81 MAPT (0.36) MAPTHPGDMAPK1KDM4EALDH1A1
SCHEMBL27526999 0.80 MAPT (0.32) MAPTHPGDMAPK1KDM4EALDH1A1
SCHEMBL7168637 0.78 MAPT (0.38) MAPTHPGDMAPK1KDM4EALDH1A1
SCHEMBL5014917 0.77 ARG1 (0.36) MAPTHPGDMAPK1KDM4EALDH1A1
SCHEMBL4763802 0.77 MAPT (0.39) MAPT
SCHEMBL5965815 0.77 ARG1 (0.36) MAPTHPGDMAPK1KDM4EALDH1A1
SCHEMBL10621382 0.76
SCHEMBL19953391 0.76 MAPT (0.36) MAPTHPGDMAPK1KDM4EALDH1A1

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
EP-1092737-B1 Catalyst composition for the production of a polyurethane resin, and method for producing a polyurethane resin TOSOH CORP (JP) 2003-09-24 EP claimed
WO-2025216845-A1 PAINT AND COATING FORMULATIONS INCLUDING 3-AMINO-2-BUTANOL AND USES THEREOF ADVANCION CORPORATION (US) 2025-10-16 WO disclosed