SCHEMBL10340609

SCHEMBL10340609

NC(=O)c1c(C(=O)O)cnn1-c1cccc(Cl)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.45
NOTUM Q6P988 3/20 0.45
RIPK2 O43353 1/20 0.40
P2RX7 Q99572 4/20 0.40
HAVCR2 Q8TDQ0 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PARP1 P09874 1/20 0.37
FGFR1 P11362 1/20 0.37
SRC P12931 1/20 0.37
FGFR2 P21802 1/20 0.37
FGFR4 P22455 1/20 0.37
FGFR3 P22607 1/20 0.37
KDR P35968 1/20 0.37
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
NR4A3 Q92570 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL10340607 0.87 RIPK2 (0.39) TSHRNOTUMRIPK2ALDH1A1L3MBTL1
SCHEMBL14692428 0.83 FGFR1 (0.51) TSHRNOTUMRIPK2P2RX7HAVCR2
SCHEMBL8047299 0.81 RIPK2 (0.56) TSHRRIPK2P2RX7PARP1FGFR1
SCHEMBL10340615 0.78 ALDH1A1 (0.48) TSHRNOTUMALDH1A1SMN1; SMN2CNR2
SCHEMBL10894540 0.77 MALT1 (0.45) TSHRNOTUMP2RX7MEN1KMT2A
SCHEMBL10340538 0.77 HTT (0.51) NOTUMRIPK2KMT2APARP1ALDH1A1
SCHEMBL6319872 0.76 KEAP1 (0.61) MEN1KMT2A
SCHEMBL10340610 0.75 RIPK2 (0.64) RIPK2ALDH1A1L3MBTL1NR4A3POLB
SCHEMBL10340641 0.74 PTPN1 (0.50) TSHRNOTUMRIPK2MEN1KMT2A
SCHEMBL10340584 0.74 NOTUM (0.45) NOTUMRIPK2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0177242-B1 POLLEN FORMATION INHIBITING PYRAZOLES ELI LILLY AND COMPANY (US) 1990-01-03 EP disclosed
US-4775409-A PREVENTING POLLEN FORMATION ELI LILLY AND COMPANY (US) 1988-10-04 US disclosed
US-4666504-A HYBRIDS ELI LILLY AND COMPANY (US) 1987-05-19 US disclosed
EP-0177242-A2 Pollen formation inhibiting pyrazoles ELI LILLY AND COMPANY (US) 1986-04-09 EP disclosed