SCHEMBL20195656

SCHEMBL20195656

Cc1cccnc1OCc1c(F)cccc1C(=O)Cl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
SGMS2 Q8NHU3 2/20 0.39
MAPK8 P45983 1/20 0.39
NPC1 O15118 2/20 0.38
GLA P06280 1/20 0.38
TSHR P16473 1/20 0.38
P2RX7 Q99572 1/20 0.37
CTNNB1 P35222 1/20 0.36
WNT3A P56704 1/20 0.36
MAPK1 P28482 1/20 0.36
CTSA P10619 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL20195627 0.86 ALDH1A1 (0.48) L3MBTL1ALDH1A1KMT2AATMTDP1
SCHEMBL20195552 0.83 ALDH1A1 (0.43) L3MBTL1ALDH1A1KMT2AATMLMNA
SCHEMBL20195498 0.81 SSTR4 (0.41) ALDH1A1CNR1CNR2
SCHEMBL20195647 0.78 KDM4E (0.44) L3MBTL1ALDH1A1TDP1LMNAALOX15
SCHEMBL20195585 0.72 ATP4A (0.43) ALDH1A1KMT2ATDP1SGMS2MAPK8
SCHEMBL20195598 0.72 KMT2A (0.49) L3MBTL1ALDH1A1KMT2AATMSGMS2
SCHEMBL30749508 0.72 TDP1 (0.44) L3MBTL1ALDH1A1KMT2ATDP1MAPK8
SCHEMBL29209338 0.72 TDP1 (0.44) L3MBTL1ALDH1A1KMT2ATDP1MAPK8
SCHEMBL23286656 0.71 NPC1 (0.45) L3MBTL1TDP1LMNASGMS2NPC1
SCHEMBL17788248 0.71 MRGPRX4 (0.46) ALDH1A1LMNAALOX15SGMS2

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
EP-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed