SCHEMBL18360463

SCHEMBL18360463

CC(=O)c1sc(NC(=O)c2ccc3c(c2)B(O)OC3)nc1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.60
NPC1 O15118 8/20 0.60
KMT2A Q03164 6/20 0.60
RXFP1 Q9HBX9 4/20 0.60
MEN1 O00255 4/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
GAA P10253 3/20 0.60
KDM4E B2RXH2 3/20 0.60
ALDH1A1 P00352 3/20 0.58
NPSR1 Q6W5P4 1/20 0.56
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
PPARG P37231 1/20 0.49
NR2E3 Q9Y5X4 1/20 0.49
NCOR2 Q9Y618 1/20 0.49
CA12 O43570 2/20 0.49
CA9 Q16790 2/20 0.49
PKM P14618 1/20 0.48
CA4 P22748 1/20 0.48
HPGD P15428 1/20 0.46

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
SCHEMBL18360529 0.82 RAB9A (0.54) RAB9ANPC1KMT2ARXFP1MEN1
SCHEMBL18360528 0.82 KMT2A (0.49) RAB9ANPC1KMT2ARXFP1MEN1
SCHEMBL18354547 0.81 NPC1 (0.57) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL18355039 0.80 MAPT (0.59) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL18360552 0.79 KDM4E (0.53) RAB9ANPC1KMT2ARXFP1MEN1
SCHEMBL18355042 0.75 POLB (0.53) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL28482095 0.74 RAB9A (0.84) RAB9ANPC1KMT2ARXFP1MEN1
SCHEMBL22939825 0.74 CA1 (0.73) CA1CA2CA12CA9CA4
SCHEMBL18360550 0.73 CA1 (0.52) KMT2ACA1CA2CA12CA9
SCHEMBL24459619 0.73 CA1 (0.68) CA1CA2CA12CA9CA4

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 RAB9A 1828/4885NPC1 1614/4885KMT2A 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.