SCHEMBL4937449

SCHEMBL4937449

COCCNC(=O)c1cc(COS(C)(=O)=O)ccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 6/20 0.46
LOX P28300 4/20 0.44
KIT P10721 2/20 0.43
BRAF P15056 2/20 0.43
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK14 Q16539 1/20 0.41
CYP4F2 P78329 2/20 0.40
CYP4A11 Q02928 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 1/20 0.40
CA2 P00918 2/20 0.39
CA4 P22748 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA3 P07451 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL4941679 0.86 PARP1 (0.46) LOXL2KITBRAFCYP4F2CYP4A11
SCHEMBL4307516 0.83 PARP1 (0.45) LOXL2KIT
SCHEMBL10204398 0.82 ALDH1A1 (0.45) HPGDALDH1A1LMNAKDM4EHSD17B10
SCHEMBL18049360 0.81 LOXL2 (0.66) LOXL2LOXKITBRAFHPGD
SCHEMBL4945290 0.81 HPGD (0.47) LOXL2LOXKITBRAFHPGD
SCHEMBL4941722 0.81 SMYD3 (0.60) KITBRAF
Hydrochloric Acid SCHEMBL18049316 0.80 LOXL2 (0.65) LOXL2LOXKITBRAFHPGD
SCHEMBL1166333 0.79 ALDH1A1 (0.39) LOXL2ALDH1A1CYP4F2CYP4A11RAB9A
SCHEMBL4310539 0.78 CYP4F2 (0.46) LOXL2CYP4F2CYP4A11CYP1A2
Lufironil SCHEMBL344625 0.76 HPGD (0.56) LOXL2LOXHPGDALDH1A1

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-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents BAYER PHARMACEUTICALS CORPORATION (US) 2008-11-27 US disclosed
US-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents BAYER PHARMACEUTICALS CORPORATION (US) 2008-11-27 US disclosed
US-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents BAYER PHARMACEUTICALS CORPORATION (US) 2008-11-27 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-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents ABCC3, HCCS, ABCC2 LOXL2 4559/4885LOX 4601/4885KIT 2298/4885

“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.