SCHEMBL29016453

SCHEMBL29016453

CCOc1cc(C2CCC(CC)CC2)c(-c2ccccc2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SSTR5 P35346 14/20 0.37
▸ KCNH2 Q12809 4/20 0.37
▸ SSTR3 P32745 1/20 0.35
▸ CNR2 P34972 1/20 0.34
▸ CAMKK1 Q8N5S9 1/20 0.32
▸ CAMKK2 Q96RR4 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL29016451 0.87 PTGDR2 (0.40) SSTR5KCNH2CAMKK1CAMKK2PTGDR2
SCHEMBL9405698 0.76 KDM1A (0.36) SSTR5KCNH2SSTR3CNR2L3MBTL1
SCHEMBL12716045 0.76 KDM1A (0.36) SSTR5KCNH2SSTR3CNR2L3MBTL1
SCHEMBL9405701 0.76 KDM1A (0.36) SSTR5KCNH2SSTR3CNR2L3MBTL1
SCHEMBL29016455 0.73 HCRTR2 (0.34) L3MBTL1
SCHEMBL7935723 0.72 OPRL1 (0.34) —
SCHEMBL9630260 0.72 OPRL1 (0.34) —
SCHEMBL9630268 0.72 OPRL1 (0.34) —
SCHEMBL9631105 0.72 KDM1A (0.34) —
SCHEMBL5849019 0.72 KDM1A (0.34) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116254121-A Negative liquid crystal mixture, display panel, display device and driving method 北京京东方显示技术有限公司 2023-06-13 — — CN claimed
CN-116254121-A Negative liquid crystal mixture, display panel, display device and driving method 北京京东方显示技术有限公司 2023-06-13 — — CN disclosed
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