SCHEMBL8044641

SCHEMBL8044641

CCC1CCC(C(=O)Oc2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
F2 P00734 1/20 0.48
ELANE P08246 2/20 0.48
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CA2 P00918 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL8449391 1.00 KMT2A (0.53) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL11130670 0.96 KMT2A (0.49) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL11108679 0.96 KMT2A (0.49) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL11108685 0.96 KMT2A (0.49) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL12154218 0.92 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL20045170 0.92 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL11034970 0.92 SMN1; SMN2 (0.45) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL11034967 0.92 SMN1; SMN2 (0.45) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL11134773 0.92 ELANE (0.48) KMT2AHTTSMN1; SMN2TDP1F2
SCHEMBL10618598 0.89 KMT2A (0.45) KMT2AHTTSMN1; SMN2TDP1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733692-B1 Liquid crystalline compound, liquid crystal composition containing the same, and display device CHISSO CORP (JP) 2000-06-14 EP disclosed
EP-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5714088-A TRIFLUOROMETHYL- OR -METHOXYPHENYL-SUBSTITUTED BRANCHED ALKYL-SUBSTITUTED CYCLOHEXANES; LARGE POSITIVE VALUE OF DIELECTRIC ANISOTROPY; VERY LOW VISCOSITY; HIGH VOLTAGE HOLDING RATIO(SPECIFIC RESISTANCE); UV STABILITY CHISSO CORPORATION (JP) 1998-02-03 US disclosed
CN-1140194-A Liquid crystalline compound having branched alkyl group at its side chain and liquid crystal composition containing the same CHISSO CORP (JP) 1997-01-15 CN disclosed
EP-0733692-A1 Liquid crystalline compound, liquid crystal composition containing the same, and display device Chisso Corporation (JP) 1996-09-25 EP disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed