SCHEMBL22277293

SCHEMBL22277293

C=CCCC1CCC(C2CCC(C3CCC(CCc4ccc(OCC)c(F)c4F)CC3)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30

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
SCHEMBL17154214 1.00 HTR2A (0.30) HTR2AHTR2C
SCHEMBL13235337 0.91 HTR2C (0.32) HTR2AHTR2C
SCHEMBL22277631 0.91 ALOX5 (0.34)
SCHEMBL13235357 0.91 HTR2C (0.32) HTR2AHTR2C
SCHEMBL10066145 0.91 CTSL (0.33)
SCHEMBL22277734 0.91 HTR2A (0.30) HTR2AHTR2C
SCHEMBL22277694 0.90 KDM1A (0.33)
SCHEMBL22277567 0.87 NAAA (0.35)
SCHEMBL22277625 0.87
SCHEMBL13417733 0.86 RIPK1 (0.35) HTR2AHTR2C

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
US-20200239775-A1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-07-30 US disclosed