SCHEMBL8300716

SCHEMBL8300716

Cc1ccc(-c2nc(-c3c(F)cccc3Cl)nn2C)cc1Oc1ccc(C(F)(F)F)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 1/20 0.38
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.35
ORAI1 Q96D31 1/20 0.35
IDO1 P14902 1/20 0.35
THRB P10828 1/20 0.35
SCN9A Q15858 3/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 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
SCHEMBL8304314 0.94 KMT2A (0.48) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8303158 0.92 KMT2A (0.48) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8304023 0.92 KMT2A (0.44) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8300520 0.90 KMT2A (0.47) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8298899 0.89 KMT2A (0.47) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8300833 0.87 KMT2A (0.50) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8303496 0.85 TSHR (0.47) KMT2AL3MBTL1SMN1; SMN2TSHRHPGD
SCHEMBL8304674 0.84 GABRA5 (0.38) KMT2AL3MBTL1KDM4ENPSR1MAPK1
SCHEMBL8942500 0.82 MRGPRX4 (0.41) KMT2AKDM4ENPSR1MEN1POLB
SCHEMBL8299568 0.82 THRB (0.44) KMT2AMAPK1LMNAIDO1THRB

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