SCHEMBL588368

SCHEMBL588368

Cc1cc(OC(=O)c2ccc(Br)c(OCCn3nnc(C)n3)c2C)n(C)n1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL587840 0.84 MAPT (0.32) MAPTALOX15KMT2A
SCHEMBL587810 0.83 MEN1 (0.37) LMNAHPGDHTTSMN1; SMN2MAPT
SCHEMBL587445 0.82 MAPT (0.31) MAPTALOX15KMT2A
SCHEMBL587899 0.82 MAPT (0.31) MAPTALOX15KMT2A
SCHEMBL587561 0.82 SMN1; SMN2 (0.38) LMNAHPGDHTTSMN1; SMN2MAPT
SCHEMBL587521 0.81 SMN1; SMN2 (0.38) LMNAHPGDHTTSMN1; SMN2KMT2A
SCHEMBL587955 0.76
SCHEMBL587560 0.73 HPGD (0.33) HPGDMAPTALOX15KMT2AALDH1A1
SCHEMBL587234 0.69 POLB (0.31) MAPTALOX15KMT2A
SCHEMBL587873 0.65 MAPK1 (0.37) LMNAMAPTALOX15KMT2A

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
EP-2081925-B1 Benzoylpyrazoles, their use as herbicides, and intermediates BAYER CROPSCIENCE AG (DE) 2012-02-15 EP disclosed
US-8084398-B2 Benzoylpyrazoles and herbicide BAYER CROPSCIENCE AG (DE) 2011-12-27 US disclosed
US-20100094023-A1 BENZOYLPYRAZOLES AND HERBICIDE BAYER CROPSCIENCE AG (DE) 2010-04-15 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-20100094023-A1 BENZOYLPYRAZOLES AND HERBICIDE ATL3, AHR, HACL2 LMNA 4205/4885HPGD 3420/4885HTT 340/4885

“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.