SCHEMBL7651952

SCHEMBL7651952

FC(F)(F)c1ccc(CCNC(=S)NC2=CC[CH]C=C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
LMNA P02545 4/20 0.49
MAPT P10636 4/20 0.49
HTT P42858 2/20 0.49
CDK1 P06493 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
CNR1 P21554 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 1/20 0.39
PLAAT4 Q9UL19 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL7661828 0.88 TACR1 (0.39) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7594773 0.86 MAPT (0.52) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7915018 0.86 LMNA (0.48) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7599729 0.84 RAB9A (0.51) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL7914787 0.78 MYC (0.48) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7642827 0.78 ALDH1A1 (0.53) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7904722 0.76 MAPT (0.63) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL7639607 0.76 TRPV1 (0.46)
SCHEMBL7641142 0.75 NPC1 (0.58) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7637941 0.73 GAA (0.48) KMT2AMEN1LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407249-B1 COMPOUNDS CONTAINING FURAN RING STRUCTURE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed
US-6207715-B1 USEFUL IN THERAPY OF DISEASES ASSOCIATED WITH HERPES VIRUSES INCLUDING HUMAN CYTOMEGALOVIRUS, HERPES SIMPLEX VIRUSES, EPSTEIN-BARR VIRUS, VARICELLA-ZOSTER VIRUS, HUMAN HERPESVIRUSES-6 AND -7, AND KAPOSI HERPES VIRUS AMERICAN HOME PRODUCTS CORPORATION 2001-03-27 US disclosed