SCHEMBL28021402

SCHEMBL28021402

CCCCc1ccc(F)c(CCCC)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.44
NOS1 P29475 1/20 0.44
HTT P42858 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CTRC Q99895 1/20 0.37
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GCGR P47871 3/20 0.33
METAP2 P50579 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
SCHEMBL28021383 0.83 NOS1 (0.37) TYRNOS1HPGD
SCHEMBL21399635 0.83 TYR (0.47) TYRHTTMEN1KMT2ATP53
SCHEMBL8089690 0.80 TYR (0.44) TYRHTTMEN1KMT2ATP53
SCHEMBL11774668 0.79 TYR (0.46) TYRHTTMEN1KMT2ATP53
SCHEMBL19160424 0.79 TYR (0.50) TYRHTTMEN1KMT2ATP53
SCHEMBL27548301 0.78 TYR (0.43) TYRHTTMEN1KMT2ATP53
SCHEMBL12238347 0.78 TYR (0.46) TYRHTTMEN1KMT2ATP53
SCHEMBL26240937 0.78 TYR (0.47) TYRHTTMEN1KMT2ATP53
SCHEMBL30044969 0.75 TYR (0.50) TYRHTTMEN1KMT2ATP53
SCHEMBL4633219 0.75 TYR (0.50) TYRHTTMEN1KMT2ATP53

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
CN-104744613-A Half-metallocene catalyst containing fluorobenzene amidine, preparation method and application thereof SUZHOU APAC BIOLOG SCIENCE & TECHNOLOGY CO LTD 2015-07-01 CN claimed