SCHEMBL29787159

SCHEMBL29787159

COc1c(OCCCC(=O)O)ccc(CO)c1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
POLB P06746 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.40
PKM P14618 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PPARA Q07869 1/20 0.38
MAPT P10636 3/20 0.37
HPGD P15428 2/20 0.37
CYSLTR2 Q9NS75 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL8950197 0.81 KDM4E (0.47) TRPV1LMNASMN1; SMN2POLBALDH1A1
SCHEMBL25195910 0.81 LMNA (0.40) TRPV1LMNASMN1; SMN2POLBALDH1A1
SCHEMBL7086937 0.77 LMNA (0.51) LMNAALDH1A1TSHRFFAR4
SCHEMBL4101467 0.75 ALDH1A1 (0.51) TRPV1LMNASMN1; SMN2POLBALDH1A1
SCHEMBL7530474 0.74 CYP1A2 (0.47) POLBALDH1A1TSHRTDP1L3MBTL1
SCHEMBL329986 0.74 RAB9A (0.47) LMNASMN1; SMN2ALDH1A1HTTTSHR
SCHEMBL8921062 0.70 TSHR (0.51) LMNASMN1; SMN2POLBALDH1A1TSHR
SCHEMBL215343 0.70 TDP1 (0.46) TRPV1LMNASMN1; SMN2POLBALDH1A1
SCHEMBL7564651 0.69 ALDH1A1 (0.51) LMNASMN1; SMN2ALDH1A1HTTKDM4E
SCHEMBL120379 0.69 DHFR (0.48) TSHRFFAR4PPARA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114931629-A Application of biological gelatin modified by o-nitrosobenzaldehyde group in preparation of drugs for preventing or treating inflammatory bowel diseases 浙江大学医学院附属邵逸夫医院 2022-08-23 CN claimed
CN-114931629-B Application of o-nitrosobenzaldehyde group modified biological gelatin in preparation of medicines for preventing or treating inflammatory bowel disease 浙江大学医学院附属邵逸夫医院 2025-07-01 CN disclosed
CN-114931629-A Application of biological gelatin modified by o-nitrosobenzaldehyde group in preparation of drugs for preventing or treating inflammatory bowel diseases 浙江大学医学院附属邵逸夫医院 2022-08-23 CN disclosed
CN-114931629-A Application of biological gelatin modified by o-nitrosobenzaldehyde group in preparation of drugs for preventing or treating inflammatory bowel diseases 浙江大学医学院附属邵逸夫医院 2022-08-23 CN disclosed