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Sugi Predict / Compounds / SCHEMBL28694265

SCHEMBL28694265

SCHEMBL28694265

CCCC(=O)c1ccc(OCc2ccccc2)c2[nH]c(=O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.39
▸ SRD5A2 P31213 1/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ MTNR1A P48039 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ THRA P10827 1/20 0.38
▸ THRB P10828 1/20 0.38

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
SCHEMBL18993738 0.87 SMN1; SMN2 (0.41) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL99439 0.87 HPGDS (0.44) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL867483 0.87 SMN1; SMN2 (0.41) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL18993737 0.87 SMN1; SMN2 (0.41) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL29498305 0.87 MAPT (0.54) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL98338 0.87 MAPT (0.54) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL9565258 0.84 SMN1; SMN2 (0.42) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL1205431 0.82 SMN1; SMN2 (0.41) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL28690748 0.82 L3MBTL1 (0.40) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1
SCHEMBL17513842 0.81 HTT (0.45) MAPTSMN1; SMN2CYP2C9CYP2C19TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213323-B New process for synthesizing procaterol hydrochloride 四川美域高生物医药科技有限公司 2023-06-02 — — CN claimed
CN-114105872-B Intermediate for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2023-05-23 — — CN claimed
CN-114195712-B Intermediate capable of being used for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2023-05-16 — — CN claimed
CN-114213323-A Novel process for synthesizing procaterol hydrochloride 四川美域高生物医药科技有限公司 2022-03-22 — — CN claimed
CN-114195712-A Intermediate capable of being used for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2022-03-18 — — CN claimed
CN-114105872-A Intermediate for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2022-03-01 — — CN claimed
CN-114213323-B New process for synthesizing procaterol hydrochloride 四川美域高生物医药科技有限公司 2023-06-02 — — CN disclosed
CN-114105872-B Intermediate for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2023-05-23 — — CN disclosed
CN-114195712-B Intermediate capable of being used for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2023-05-16 — — CN disclosed
CN-114213323-A Novel process for synthesizing procaterol hydrochloride 四川美域高生物医药科技有限公司 2022-03-22 — — CN disclosed
CN-114195712-A Intermediate capable of being used for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2022-03-18 — — CN disclosed
CN-114105872-A Intermediate for preparing procaterol hydrochloride and preparation method thereof 四川美域高生物医药科技有限公司 2022-03-01 — — CN disclosed