SCHEMBL10458074

SCHEMBL10458074

FCCOc1cccc(OCCF)c1OCCF

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
KCNH2 Q12809 3/20 0.52
CHRM2 P08172 2/20 0.52
TSHR P16473 2/20 0.52
CHRM1 P11229 1/20 0.52
ALOX15 P16050 1/20 0.52
ACHE P22303 1/20 0.52
HIF1A Q16665 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
MAPK1 P28482 2/20 0.40
HTR1B P28222 2/20 0.39
HTR1A P08908 2/20 0.39
ADRA1D P25100 2/20 0.39
ADRA1A P35348 2/20 0.39
ADRA1B P35368 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL10458241 0.90 SMN1; SMN2 (0.68) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL10458228 0.86 HTR1A (0.45) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL7912627 0.86 LMNA (0.41) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL2821419 0.86 KCNH2 (0.41) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL10458197 0.82 KCNH2 (0.39) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL10456757 0.82 KCNH2 (0.39) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL27919459 0.82 L3MBTL1 (0.47) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL2936738 0.82 KDM4E (0.61) LMNAKCNH2SMN1; SMN2KDM4EL3MBTL1
SCHEMBL10458167 0.81 ALDH1A1 (0.56) LMNAKCNH2CHRM2TSHRCHRM1
SCHEMBL10458201 0.81 L3MBTL1 (0.43) LMNAKCNH2CHRM2TSHRCHRM1

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
US-4960884-A Insecticides, nematocides, pesticides and miticides FMC CORPORATION (US) 1990-10-02 US claimed
CN-113930246-B Liquid crystal compound and application thereof 北京云基科技股份有限公司 2023-04-11 CN disclosed
CN-114196417-A Liquid crystal compound containing cyclopentyl and application 北京云基科技有限公司 2022-03-18 CN disclosed
CN-113930246-A Liquid crystal compound and application thereof 北京云基科技有限公司 2022-01-14 CN disclosed