SCHEMBL15445706

SCHEMBL15445706

Cc1ccc(C(=O)C2CCC(C)CC2)c(Cl)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.37
HTR1F P30939 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
POLB P06746 1/20 0.33
GRM1 Q13255 1/20 0.33
P2RX7 Q99572 1/20 0.33
ALDH1A1 P00352 3/20 0.33
HSD11B1 P28845 2/20 0.33
CPS1 P31327 1/20 0.33
MGLL Q99685 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
TP53 P04637 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL15445729 0.96 HPGD (0.35) HPGDHTR1FSMN1; SMN2KDM4EHTT
SCHEMBL15445707 0.88 TAS1R3 (0.36) HPGDHTR1FSMN1; SMN2KDM4EHTT
SCHEMBL15445705 0.86 TAS1R3 (0.36) HPGDHTR1FSMN1; SMN2KDM4EHTT
SCHEMBL12205092 0.86 HPGD (0.46) HPGDHTR1FSMN1; SMN2KDM4EHTT
SCHEMBL15445724 0.85 TAS1R3 (0.34) HPGDHTR1FSMN1; SMN2KDM4EHTT
SCHEMBL15445741 0.84 HTR1F (0.30) HTR1F
SCHEMBL15446029 0.84 HTR1F (0.30) HTR1F
SCHEMBL15445716 0.82 HPGD (0.33) HPGDHTR1FP2RX7ALDH1A1
SCHEMBL14866526 0.82 HPGD (0.43) HPGDHTR1FSMN1; SMN2KDM4EHTT
SCHEMBL15445726 0.82 TAS1R3 (0.34) HPGDHTR1FSMN1; SMN2KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295511-A1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-09-21 US disclosed
US-9714381-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-07-25 US disclosed
US-9580653-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-02-28 US disclosed
US-20160046863-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2016-02-18 US disclosed
US-20150322342-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-11-12 US disclosed
US-20150166890-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-06-18 US disclosed
US-20140028964-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2014-01-30 US disclosed