SCHEMBL30719989

SCHEMBL30719989

CC(=O)c1ccccc1CCC(SCC1(CC(=O)O)CC1)c1cccc(/C=C/c2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR1 Q9Y271 11/20 0.82
▸ CYSLTR2 Q9NS75 10/20 0.81
▸ CYP2C8 P10632 2/20 0.81
▸ MEN1 O00255 1/20 0.81
▸ RECQL P46063 1/20 0.81
▸ BLM P54132 1/20 0.81
▸ KMT2A Q03164 1/20 0.81
▸ ABCB11 O95342 1/20 0.81
▸ EGFR P00533 1/20 0.81
▸ ESR1 P03372 1/20 0.81
▸ NR3C1 P04150 1/20 0.81
▸ FYN P06241 1/20 0.81
▸ PGR P06401 1/20 0.81
▸ ADRB2 P07550 1/20 0.81
▸ ADRB1 P08588 1/20 0.81
▸ ADRA2A P08913 1/20 0.81
▸ ADORA3 P0DMS8 1/20 0.81
▸ CHRM1 P11229 1/20 0.81
▸ ADRB3 P13945 1/20 0.81
▸ ADRA2B P18089 1/20 0.81

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
SCHEMBL537796 1.00 CYSLTR1 (0.82) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL538485 1.00 CYSLTR1 (0.82) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL538484 1.00 CYSLTR1 (0.82) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL12702837 1.00 CYSLTR1 (0.82) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL8761836 1.00 CYSLTR1 (0.82) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL3415118 0.94 CYSLTR1 (0.80) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL30719988 0.94 CYSLTR1 (0.80) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL30697130 0.94 CYSLTR1 (0.80) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL29543048 0.94 CYSLTR1 (0.80) CYSLTR1CYSLTR2CYP2C8MEN1RECQL
SCHEMBL28103200 0.94 CYSLTR1 (0.80) CYSLTR1CYSLTR2CYP2C8MEN1RECQL

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-119335086-A Quality detection method of Montelukast chewable tablet 海南锦瑞制药有限公司 2025-01-21 — — CN claimed
CN-119335086-A Quality detection method of Montelukast chewable tablet 海南锦瑞制药有限公司 2025-01-21 — — CN disclosed
CN-117731620-B High-stability montelukast sodium granule preparation and preparation method thereof 翎耀生物科技(上海)有限公司 2024-07-19 — — CN disclosed
CN-117320697-A Film coated tablet comprising montelukast or a pharmaceutically acceptable salt thereof and levocetirizine or a pharmaceutically acceptable salt thereof with improved stability 韩和制药株式会社 2023-12-29 — — CN disclosed
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