SCHEMBL7907962

SCHEMBL7907962

CCCc1ccc(-c2c(F)cc(CCc3ccc(OCC)cc3)cc2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.43
RAB9A P51151 3/20 0.42
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NQO1 P15559 1/20 0.41
THRB P10828 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 2/20 0.38
TP53 P04637 2/20 0.38
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
ALDH1A1 P00352 4/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38

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
SCHEMBL7907955 0.87 GPR84 (0.42) GPR84RAB9AMAPTL3MBTL1NQO1
SCHEMBL8632330 0.86 GPR84 (0.40) GPR84RAB9AMAPTL3MBTL1NQO1
SCHEMBL13632415 0.84 NPC1 (0.44) RAB9AMAPTMEN1KMT2ANPC1
SCHEMBL9664462 0.82 NQO1 (0.56) GPR84RAB9AMAPTL3MBTL1NQO1
SCHEMBL8110627 0.81 NQO1 (0.50) GPR84NQO1SLC5A1SLC5A2SMN1; SMN2
SCHEMBL10613369 0.81 NQO1 (0.58) RAB9AMAPTL3MBTL1NQO1THRB
SCHEMBL17614864 0.81 NQO1 (0.58) RAB9AMAPTL3MBTL1NQO1THRB
SCHEMBL25548946 0.80 NQO1 (0.64) GPR84RAB9AMAPTL3MBTL1NQO1
SCHEMBL14634095 0.79 FFAR4 (0.43) RAB9AMAPTL3MBTL1NQO1THRB
SCHEMBL9662973 0.79 S1PR1 (0.47) RAB9AMAPTL3MBTL1THRBNPC1

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-6326066-B1 CHEMICAL STABILITY, LOW VISCOSITY, HIGH DIELECTRIC ANISOTROPY, ULTRAVIOLET AND TEMPERATURE STABILITY; USED IN ELECTROOPTICS MERCK PATENT GESELLSCHAFT MIT RESCHANKTER HAFTUNG (DE) 2001-12-04 US disclosed
US-6200654-B1 ELECTROOPTIC DISPLAYING MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2001-03-13 US disclosed
EP-0721933-B1 1,4-Disubstituted 2,6-difluorobenzene compounds and liquid crystal media MERCK PATENT GMBH (DE) 1999-07-07 EP disclosed
EP-0462237-B1 1,2-DISUBSTITUTED 2,6-DIFLUOROBENZENE COMPOUNDS AND LIQUID CRYSTAL MEDIA MERCK PATENT GMBH (DE) 1997-03-12 EP disclosed
EP-0721933-A1 1,4-Disubstituted 2,6-difluorobenzene compounds and liquid crystal media MERCK PATENT GmbH (DE) 1996-07-17 EP disclosed
EP-0462237-A1 1,2-DISUBSTITUTED 2,6-DIFLUOROBENZENE COMPOUNDS AND LIQUID CRYSTAL MEDIA. MERCK PATENT GMBH (DE) 1991-12-27 EP disclosed
WO-1991008184-A2 1,2-DISUBSTITUTED 2,6-DIFLUOROBENZENE COMPOUNDS AND LIQUID CRYSTAL MEDIA MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1991-06-13 WO disclosed