SCHEMBL8680504

SCHEMBL8680504

NCCc1cccc(O)c1CCN

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 9/20 0.65
HTR2C P28335 1/20 0.49
HMGB1 P09429 1/20 0.47
MEN1 O00255 2/20 0.45
RAD52 P43351 2/20 0.45
RECQL P46063 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
GAPDH P04406 1/20 0.45
THRB P10828 1/20 0.45
APEX1 P27695 1/20 0.45
BLM P54132 1/20 0.45
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
AGO2 Q9UKV8 1/20 0.43
HTR2A P28223 1/20 0.41

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
SCHEMBL6561560 0.88 TAAR1 (0.57) TAAR1HTR2CHMGB1MEN1RAD52
SCHEMBL633550 0.86 TAAR1 (0.56) TAAR1HTR2CHMGB1MEN1RAD52
Hydrochloric Acid SCHEMBL38660562 0.84 TAAR1 (0.54) TAAR1HTR2CHMGB1MEN1RAD52
SCHEMBL6959096 0.84 TAAR1 (0.54) TAAR1HTR2CHMGB1HTR2A
SCHEMBL11833247 0.82 BID (0.51) TAAR1KDM4EMAPTALOX15HSD17B10
SCHEMBL29531687 0.80 TAAR1 (0.68) TAAR1HTR2CHMGB1MEN1RAD52
SCHEMBL68660 0.80 TAAR1 (0.68) TAAR1HTR2CHMGB1MEN1RAD52
SCHEMBL18469204 0.80 TAAR1 (0.68) TAAR1HTR2CHMGB1MEN1RAD52
SCHEMBL1427697 0.79 TAAR1 (1.00) TAAR1HTR2CMEN1RAD52RECQL
SCHEMBL29769908 0.79 TAAR1 (1.00) TAAR1HTR2CMEN1RAD52RECQL

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
WO-1998033841-A1 POLYOLEFIN POLYMER WITH HIGH MOLECULAR WEIGHT DSM N.V. (NL) 1998-08-06 WO disclosed