SCHEMBL8300833

SCHEMBL8300833

Cc1ccc(-c2nc(-c3ccccc3Cl)nn2C)cc1Oc1ccc(C(F)(F)F)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
HPGD P15428 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 1/20 0.38
POLB P06746 3/20 0.37
LMNA P02545 3/20 0.37
LIPE Q05469 1/20 0.37
MEN1 O00255 1/20 0.37
HSD11B1 P28845 1/20 0.37
MAPK1 P28482 1/20 0.36
PDE2A O00408 1/20 0.36
PDE10A Q9Y233 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GAA P10253 1/20 0.35
XBP1 P17861 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL8300716 0.87 KMT2A (0.45) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL8300281 0.81 KMT2A (0.47) KMT2AL3MBTL1MAPTSMN1; SMN2LMNA
SCHEMBL8304314 0.80 KMT2A (0.48) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL8300520 0.80 KMT2A (0.47) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL8303158 0.79 KMT2A (0.48) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL8304023 0.78 KMT2A (0.44) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL8298899 0.78 KMT2A (0.47) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL4611822 0.77 NR1H2 (0.47) MAPTHSD11B1PDE2APDE10ANR1H2
SCHEMBL8303496 0.74 TSHR (0.47) KMT2AHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL8304674 0.70 GABRA5 (0.38) KMT2AL3MBTL1MAPTPOLBMEN1

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-0648752-B1 TRIAZOLE DERIVATIVE, INSECTICIDAL/ACARICIDAL AGENT, AND PROCESS FOR PRODUCING THE SAME KUMIAI CHEMICAL INDUSTRY CO (JP) 1999-10-06 EP disclosed
US-5700824-A Triazole derivatives, insecticide, acaricide and methods thereof KUMIAI CHEMICAL INDUSTRIAL CO. LTD. (JP) 1997-12-23 US disclosed
US-5616594-A Triazole derivatives, insecticide, acaricide and methods thereof IHARA CHEMICAL INDUSTRY CO. LTD. (JP) 1997-04-01 US disclosed
EP-0648752-A1 TRIAZOLE DERIVATIVE, INSECTICIDAL/ACARICIDAL AGENT, AND PROCESS FOR PRODUCING THE SAME KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1995-04-19 EP disclosed