SCHEMBL18360552

SCHEMBL18360552

Cc1cccc2sc(NC(=O)c3ccc4c(c3)B(O)OC4)nc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
POLB P06746 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
USP2 O75604 1/20 0.52
ALOX15 P16050 1/20 0.52
MCL1 Q07820 1/20 0.52
ESR2 Q92731 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 6/20 0.50
LMNA P02545 6/20 0.50
HPGD P15428 5/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
RECQL P46063 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
CASP3 P42574 2/20 0.48

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
SCHEMBL18360480 0.84 KMT2A (0.55) KDM4EMEN1KMT2APOLBL3MBTL1
SCHEMBL18360500 0.84 KDM4E (0.55) KDM4EMEN1KMT2APOLBL3MBTL1
SCHEMBL18360463 0.79 RAB9A (0.60) KDM4EMEN1KMT2AHPGDALDH1A1
SCHEMBL4919617 0.79 MEN1 (0.65) KDM4EMEN1KMT2APOLBL3MBTL1
SCHEMBL18354547 0.78 NPC1 (0.57) KDM4EMEN1KMT2AALOX15TDP1
SCHEMBL18355039 0.77 MAPT (0.59) MEN1KMT2APOLBUSP2MAPT
SCHEMBL18360546 0.77 CA1 (0.56) MEN1KMT2APOLBHPGDSMN1; SMN2
SCHEMBL4920382 0.76 MAPT (0.65) KDM4EMEN1KMT2APOLBL3MBTL1
SCHEMBL18360461 0.75 CA1 (0.53) CA12CA1CA2CA9CA4
SCHEMBL5713545 0.75 MAPT (0.67) KDM4EMEN1KMT2APOLBL3MBTL1

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
US-20170000133-A1 BENZOXABOROLE FUNGICIDES SYNGENTA PARTICIPATIONS AG (SE) 2017-01-05 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 (1 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-20170000133-A1 BENZOXABOROLE FUNGICIDES CYP4X1, BROX, CYP1B1 KDM4E 992/4885MEN1 2465/4885KMT2A 2550/4885

“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.