SCHEMBL29528461

SCHEMBL29528461

CC(C)[C@H](O)[C@@H](O)c1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.55
LMNA P02545 2/20 0.55
HTT P42858 1/20 0.55
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PDE2A O00408 1/20 0.40
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ADRA2C P18825 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
TOP2A P11388 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
SCHEMBL251962 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL29528591 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL251961 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL251902 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL252484 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL29528557 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL252485 1.00 TP53 (0.55) TP53LMNAHTTMEN1KMT2A
SCHEMBL252437 0.84 TP53 (0.59) TP53LMNAHTTMEN1KMT2A
SCHEMBL253677 0.84 TP53 (0.59) TP53LMNAHTTMEN1KMT2A
SCHEMBL29529206 0.84 TP53 (0.59) TP53LMNAHTTMEN1KMT2A

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