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SCHEMBL10535979

SCHEMBL10535979

CCC1CC=C(c2cccc(F)c2F)CC1.CCCC1CC=C(c2cccc(F)c2F)CC1.CCCCC1CC=C(c2cccc(F)c2F)CC1.CCCCCCC1CC=C(c2cccc(F)c2F)CC1.CCCCCCCC1CC=C(c2cccc(F)c2F)CC1.CCCCCCCCC1CC=C(c2cccc(F)c2F)CC1

nearest known ligand 0.30

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 2/20 0.30
▸ CDK9 P50750 2/20 0.30
▸ GRM2 Q14416 1/20 0.30
▸ HDAC3 O15379 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ HDAC6 Q9UBN7 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
SCHEMBL9494782 0.93 GRM2 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL9493202 0.93 GRM2 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL9419289 0.93 GRM2 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL9493947 0.93 GRM2 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL9497782 0.93 GRM2 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL9493359 0.93 GRM2 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL730117 0.92 HDAC3 (0.34) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL9497022 0.91 HDAC3 (0.34) CCNT1CDK9HDAC3HDAC1HDAC2
SCHEMBL7728087 0.90 HDAC3 (0.33) CCNT1CDK9GRM2HDAC3HDAC1
SCHEMBL7728084 0.90 HDAC3 (0.33) CCNT1CDK9GRM2HDAC3HDAC1

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
WO-1989002425-A1 FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-03-23 — — WO disclosed