SCHEMBL29528779

SCHEMBL29528779

CC/C=C/c1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHAT P28329 1/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 2/20 0.46
LMNA P02545 1/20 0.46
NFE2L2 Q16236 4/20 0.46
CYP1A2 P05177 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
RELA Q04206 1/20 0.46
APOBEC3A P31941 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
GSR P00390 1/20 0.43
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 0.43
ADRB2 P07550 1/20 0.41
ADRB1 P08588 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
SCHEMBL256666 1.00 CHAT (0.47) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL6568108 1.00 CHAT (0.47) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL20604275 0.83 TLR8 (0.45) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL20604271 0.83 TLR8 (0.45) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL9618493 0.82 IAPP (0.41) ALDH1A1SMN1; SMN2HPGDLMNARELA
SCHEMBL18642639 0.82 ALDH1A1 (0.41) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL9618494 0.82 IAPP (0.41) ALDH1A1SMN1; SMN2HPGDLMNARELA
SCHEMBL24759019 0.80 CFD (0.34) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL10323297 0.80 CHAT (0.42) CHATALDH1A1SMN1; SMN2HPGDLMNA
SCHEMBL3437033 0.80 CHAT (0.42) CHATALDH1A1SMN1; SMN2HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111419830-B Phenylalkylcarbamate compounds for use in the prevention or treatment of epilepsy and epileptic related syndromes 比皮艾思药物研发有限公司 2024-01-30 CN disclosed
CN-115996905-A Phenylalkyl carbamate compounds for use in preventing or treating neurodegenerative diseases 生物药品解决方案有限公司 2023-04-21 CN disclosed
CN-109939092-B Phenyl carbamate compounds for use in preventing or treating pediatric epilepsy and epilepsy-related syndrome 比皮艾思药物研发有限公司 2022-03-22 CN disclosed