SCHEMBL7779441

SCHEMBL7779441

[2H]C1([2H])CC([C@H]2CC[C@H](c3ccc(F)c(F)c3)CC2)CC([2H])([2H])C1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP5 P45974 2/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
USP30 Q70CQ3 1/20 0.34
KDM1A O60341 2/20 0.33
GRIA4 P48058 1/20 0.33
MAOB P27338 1/20 0.33
HCRTR2 O43614 2/20 0.33
HCAR2 Q8TDS4 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
SCHEMBL17827776 0.88 HTR2A (0.42) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL8767567 0.86 HTR2A (0.39) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL23366152 0.84 HTR2A (0.38) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL14525325 0.84 HTR2A (0.38) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL29389392 0.82 HTR2A (0.46) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL808710 0.82 HTR2A (0.46) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL7779419 0.81 USP5 (0.36) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL8767029 0.80 USP5 (0.35) USP5HDAC6HTR2AHTR2CHTR2B
Ammonia Solution, Strong SCHEMBL2142374 0.80 HTR2A (0.44) USP5HDAC6HTR2AHTR2CHTR2B
SCHEMBL8623567 0.79 ESR2 (0.48) USP5HDAC6HTR2AHTR2CHTR2B

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
EP-0637623-B1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK & CHEMICALS (JP) 2001-10-04 EP disclosed
EP-0637623-A1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-02-08 EP disclosed