SCHEMBL28742712

SCHEMBL28742712

C#CCCCCC#CCCCCCCCCC(=O)O

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.87
▸ CYP1A2 P05177 1/20 0.87
▸ CYP2D6 P10635 1/20 0.87
▸ CYP2C9 P11712 1/20 0.87
▸ CYP2C19 P33261 1/20 0.87
▸ HSD17B10 Q99714 1/20 0.87
▸ PTPN7 P35236 5/20 0.64
▸ HMGCR P04035 3/20 0.64
▸ KDM4E B2RXH2 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ HPGD P15428 2/20 0.55
▸ RECQL P46063 2/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ LMNA P02545 2/20 0.52
▸ TSHR P16473 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ PMP22 Q01453 1/20 0.52
▸ EPHX2 P34913 3/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ USP2 O75604 1/20 0.50

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
SCHEMBL2481565 1.00 MAPT (0.87) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2481564 0.96 MAPT (0.79) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL26624539 0.94 MAPT (0.76) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL28742987 0.93 MAPT (0.75) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL979048 0.93 HSD17B10 (1.00) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL12680242 0.93 HSD17B10 (1.00) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2802414 0.93 HSD17B10 (1.00) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL257132 0.93 HSD17B10 (1.00) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL740489 0.93 HSD17B10 (1.00) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL1050169 0.93 HSD17B10 (1.00) MAPTCYP1A2CYP2D6CYP2C9CYP2C19

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
WO-2023213310-A9 CARBON CHAIN SUBSTANCE FOR REGULATING TRANSMEMBRANE TRANSPORT AND FLUIDITY OF CELL MEMBRANES, AND PREPARATION AND USE THEREOF 太阳雨林(北京)生物医药有限公司 2025-02-20 — — WO disclosed
CN-115607677-A Compound for preventing, preventing or treating microbial infection and preparation and application thereof 太阳雨林(北京)生物医药有限公司 2023-01-17 — — CN disclosed
CN-114788872-A Compound for preventing, preventing or treating microbial infection and preparation and application thereof 太阳雨林(北京)生物医药有限公司 2022-07-26 — — CN disclosed
CN-114569726-A Compound for preventing, preventing or treating microbial infection and preparation method and application thereof 太阳雨林(北京)生物医药有限公司 2022-06-03 — — CN disclosed
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