SCHEMBL1225699

SCHEMBL1225699

NCCc1c[nH]c(C(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.60
RAB9A P51151 3/20 0.44
GAA P10253 1/20 0.44
TDP1 Q9NUW8 4/20 0.41
HTR7 P34969 3/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
NOTUM Q6P988 1/20 0.40
TAAR1 Q96RJ0 3/20 0.35
CYP2A6 P11509 1/20 0.35
HTR2A P28223 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.35
HTR1A P08908 4/20 0.35
ADRA2A P08913 3/20 0.35
SLC6A2 P23975 3/20 0.35
LMNA P02545 2/20 0.35
HTR1B P28222 2/20 0.35
HTR2C P28335 2/20 0.35
HTR5A P47898 2/20 0.35
HTR6 P50406 2/20 0.35
HTR1E P28566 1/20 0.35

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
SCHEMBL7258022 0.89 DAO (0.57) DAORAB9AGAATDP1HTR7
SCHEMBL875351 0.84 DAO (0.54) DAORAB9AGAATDP1HTR7
Hydrochloric Acid SCHEMBL6941257 0.82 DAO (0.53) DAORAB9AGAATDP1HTR7
SCHEMBL27680469 0.82 DAO (0.71) DAORAB9AGAATDP1SMN1; SMN2
SCHEMBL6899153 0.81 DAO (0.60) DAORAB9AGAATDP1SMN1; SMN2
SCHEMBL1149656 0.79 DAO (0.73) DAORAB9AGAANOTUMPKM
SCHEMBL27680470 0.79 DAO (0.57) DAORAB9AGAASMN1; SMN2NOTUM
SCHEMBL28943248 0.77 DAO (0.56) DAORAB9AGAATDP1HTR7
SCHEMBL12704172 0.77 DAO (0.73) DAORAB9AGAATDP1SMN1; SMN2
SCHEMBL1149736 0.77 DAO (0.64) DAORAB9AGAATDP1SMN1; SMN2

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-2281822-B1 New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB (FR) 2013-01-16 EP disclosed
EP-2281822-A1 New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2011-02-09 EP disclosed