SCHEMBL29934853

SCHEMBL29934853

CCCCC[C@H]1CC[C@H](c2c(-c3ccccc3)ccc(F)c2F)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPK1 P28482 2/20 0.38
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
OPRL1 P41146 4/20 0.32
HRH3 Q9Y5N1 1/20 0.32
KDM1A O60341 2/20 0.32
GRM2 Q14416 1/20 0.31

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
SCHEMBL9061898 1.00 GAA (0.38) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL8931543 1.00 GAA (0.38) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL28969466 0.96 GAA (0.41) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL9055883 0.91 KDM4E (0.39) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL29935072 0.91 KDM4E (0.39) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL8043456 0.86 GAA (0.36) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL29934943 0.85 TRPV3 (0.38) KDM1A
SCHEMBL9056025 0.85 TRPV3 (0.38) KDM1A
SCHEMBL10613253 0.84 GAA (0.36) GAAMEN1KMT2AMAPK1MAPT
SCHEMBL4650916 0.82 KDM4E (0.38) GAAMEN1KMT2AMAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109983398-B Optical component comprising blue phase liquid crystals and method for manufacturing such an optical component 株式会社尼康 2022-09-23 CN disclosed