SCHEMBL9336527

SCHEMBL9336527

CCCCC1CCC(C(=O)Oc2ccc(OC(F)(F)C(F)F)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ F2 P00734 1/20 0.40
▸ ELANE P08246 1/20 0.39
▸ POLB P06746 3/20 0.38
▸ TRPV1 Q8NER1 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ PLG P00747 1/20 0.36
▸ PRSS1 P07477 1/20 0.36
▸ PRSS2 P07478 1/20 0.36
▸ PRSS3 P35030 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ ATM Q13315 1/20 0.35

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
SCHEMBL9336517 1.00 MAPT (0.43) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9336657 0.97 GAA (0.41) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9336653 0.97 GAA (0.41) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9336667 0.97 GAA (0.41) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9340678 0.96 KMT2A (0.41) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9340673 0.96 KMT2A (0.41) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9336756 0.95 HTT (0.40) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9336733 0.95 HTT (0.40) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9337267 0.95 HTT (0.40) MAPTGAAKMT2AHTTSMN1; SMN2
SCHEMBL9337282 0.95 HTT (0.40) MAPTGAAKMT2AHTTSMN1; SMN2

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
US-5348677-A Electro-optical liquid crystal display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-09-20 — — US disclosed
US-5196140-A ELECTRO-OPTICAL LIQUID CRYSTAL DISPLAY ELEMENT MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-03-23 — — US disclosed
Send feedback