SCHEMBL29005651

SCHEMBL29005651

COCc1cc(OCC(=O)O)ccc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
PPARD Q03181 1/20 0.44
ALDH1A1 P00352 4/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MCL1 Q07820 1/20 0.43
PTPN7 P35236 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOB P27338 1/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL29897187 1.00 LMNA (0.46) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL29005898 0.89 SMN1; SMN2 (0.46) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL29420163 0.89 PTPN7 (0.45) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL16294585 0.89 PTPN7 (0.45) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL16285732 0.87 MAPT (0.49) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL29899356 0.87 PPARD (0.45) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL29005892 0.87 PPARD (0.45) LMNANPC1RAB9ASMN1; SMN2PPARD
SCHEMBL5030826 0.85 NPC1 (0.47) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL5030823 0.85 PTPN7 (0.46) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL3496181 0.84 MEN1 (0.41) LMNANPC1RAB9ASMN1; SMN2PPARD

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-114967325-A Diamine compound, resin prepared from same, photosensitive resin composition and application 北京鼎材科技有限公司 2022-08-30 CN disclosed
CN-114967324-A Diamine compound, resin prepared from same, photosensitive resin composition and application 北京鼎材科技有限公司 2022-08-30 CN disclosed