SCHEMBL8084411

SCHEMBL8084411

CCNc1ccc(CSc2ccnc3cc(SC)ccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.37
PRNP P04156 2/20 0.37
RXFP1 Q9HBX9 2/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 4/20 0.35
MEN1 O00255 3/20 0.35
NPC1 O15118 3/20 0.35
MAPT P10636 3/20 0.35
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 3/20 0.34
CYP2C9 P11712 3/20 0.34
CYP2C19 P33261 3/20 0.34
RECQL P46063 1/20 0.34
CYP3A4 P08684 3/20 0.33
CYP2D6 P10635 1/20 0.33
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL8084735 0.85 ALDH1A1 (0.36) KMT2APRNPRXFP1POLBRAB9A
SCHEMBL8084787 0.83 KMT2A (0.39) KMT2APRNPRXFP1POLBRAB9A
SCHEMBL8089824 0.81 PRNP (0.34) KMT2APRNPRXFP1POLBRAB9A
SCHEMBL8076742 0.81 QPCT (0.41) KMT2APRNPRXFP1POLBKDM4E
SCHEMBL8088305 0.81 PRNP (0.31) KMT2APRNPRXFP1POLB
SCHEMBL8084914 0.78 KMT2A (0.37) KMT2APRNPRXFP1POLBRAB9A
SCHEMBL8088284 0.77 PRNP (0.35) KMT2APRNPRXFP1POLBMAPT
SCHEMBL8088244 0.77 MAPKAPK2 (0.38) KMT2APRNPRXFP1POLBMEN1
SCHEMBL8084777 0.77 PRNP (0.34) KMT2APRNPRXFP1POLBKDM4E
SCHEMBL8084113 0.76 MAPKAPK2 (0.38) KMT2APRNPRXFP1POLBMEN1

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-6057447-A BACTERICIDES FOR CAMPYLOBACTER ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2000-05-02 US disclosed
EP-0926139-A1 QUINOLINE SULFIDE DERIVATIVES ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-06-30 EP disclosed