SCHEMBL8891928

SCHEMBL8891928

FC(F)(F)c1csc(NC(=S)NCCc2ccccc2Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
HTT P42858 3/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALOX12 P18054 1/20 0.41
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
EGFR P00533 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAPK1 P28482 1/20 0.40
PTPN7 P35236 1/20 0.40
DUSP3 P51452 1/20 0.40
PTPN5 P54829 1/20 0.40
PTPN11 Q06124 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
MEN1 O00255 3/20 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
SCHEMBL8885291 0.84 RXFP1 (0.48) LMNAMAPTSMN1; SMN2ALOX12ROCK2
SCHEMBL6962348 0.84 RAB9A (0.51) LMNAHTTMAPTSMN1; SMN2ALOX12
SCHEMBL8887315 0.82 MAPT (0.51) LMNAHTTMAPTSMN1; SMN2ALOX12
SCHEMBL8886510 0.81 NPC1 (0.54) LMNAHTTMAPTSMN1; SMN2ALOX12
SCHEMBL6958790 0.77 ALDH1A1 (0.60) LMNAHTTMAPTSMN1; SMN2ROCK2
SCHEMBL29352046 0.75 NPC1 (0.54) LMNAHTTMAPTSMN1; SMN2NFKB1
SCHEMBL6953553 0.75 NPC1 (0.54) LMNAHTTMAPTSMN1; SMN2NFKB1
SCHEMBL8887575 0.75 LMNA (0.56) LMNAHTTMAPTSMN1; SMN2ALOX12
SCHEMBL6963950 0.74 KMT2A (0.68) HTTMAPTSMN1; SMN2RAB9AMEN1
SCHEMBL8886524 0.74 ALDH1A1 (0.48) LMNAHTTMAPTROCK2ROCK1

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
US-5593993-A VIRICIDES FOR HTLV TREATMENT OF AIDS MEDIVIR AB (SE) 1997-01-14 US disclosed