SCHEMBL16804792

SCHEMBL16804792

CCSc1ncncc1C(=O)Nc1cc(C(F)(F)F)cnc1NC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.37
SORT1 Q99523 1/20 0.36
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PDE10A Q9Y233 1/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
JUN P05412 2/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
POLB P06746 1/20 0.35
BMX P51813 1/20 0.34
SYK P43405 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL16804777 0.83 HSD17B10 (0.42) KMT2AMEN1ALDH1A1SORT1LMNA
SCHEMBL16804775 0.82 GAA (0.44) KMT2AMEN1ALDH1A1SORT1LMNA
SCHEMBL16804795 0.82 KMT2A (0.43) KMT2AMEN1ALDH1A1SORT1PKM
SCHEMBL16804770 0.81 KMT2A (0.41) KMT2AMEN1ALDH1A1PKMLMNA
SCHEMBL9952288 0.80 RXFP1 (0.48) KMT2AMEN1ALDH1A1PKMLMNA
SCHEMBL16804767 0.80 KMT2A (0.38) KMT2AMEN1ALDH1A1SORT1LMNA
SCHEMBL17832717 0.78 KDM4E (0.40) KMT2AMEN1ALDH1A1SORT1LMNA
SCHEMBL15427240 0.77 KMT2A (0.44) KMT2AMEN1ALDH1A1SORT1LMNA
SCHEMBL22001425 0.77 KMT2A (0.44) KMT2AMEN1ALDH1A1SORT1PKM
SCHEMBL20424031 0.76 TRPV1 (0.40) KMT2ASORT1JUNNFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9364000-B2 Method of controlling pests with fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-14 US disclosed
US-20150373982-A1 METHOD OF CONTROLLING PESTS WITH FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2015-12-31 US disclosed
US-20150166573-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150373982-A1 METHOD OF CONTROLLING PESTS WITH FUSED HETEROCYCLIC COMPOUND NR4A1, NR2E1, NR0B1 KMT2A 1682/4885MEN1 996/4885ALDH1A1 2552/4885
US-20150166573-A1 FUSED HETEROCYCLIC COMPOUND NR4A1, NR2E1, NR0B2 KMT2A 1379/4885MEN1 891/4885ALDH1A1 2594/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.