SCHEMBL7912075

SCHEMBL7912075

CCCCC[C@H]1CC[C@H](c2ccc(C(F)(F)Oc3ccc(F)cc3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.37
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
SPHK1 Q9NYA1 3/20 0.35
HTR1A P08908 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD5 P21918 1/20 0.35
HTR2A P28223 1/20 0.35
DRD3 P35462 1/20 0.35
CNR2 P34972 4/20 0.33
ESR2 Q92731 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL7912069 1.00 MAPT (0.38) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL5068471 0.93 MAPT (0.45) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL5068469 0.93 MAPT (0.45) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7729750 0.92 HTR2C (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7731537 0.92 MAPT (0.39) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7729755 0.92 HTR2C (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7731541 0.92 MAPT (0.39) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7909821 0.91 ALDH1A1 (0.46) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7909828 0.91 ALDH1A1 (0.46) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL7734943 0.91 MAPT (0.38) MAPTALDH1A1LMNACYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786509-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORP (JP) 2001-09-12 EP disclosed
US-5792386-A A MIXTURE OF ALKYLCYCLOHEXYL(PHENYLENE)DIFLUROMETHOXY-BENZENES AND FLUORO-CONTAINING COMPOUNDS; LOW VISCOSITY; LOW TEMPERATURE MISCIBILITY; HEAT AND CHEMICAL RESISTANCE; ACTIVE MATRIX CHISSO CORPORATION (JP) 1998-08-11 US disclosed
EP-0786509-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1997-07-30 EP disclosed