SCHEMBL6079324

SCHEMBL6079324

Cc1c(C(=O)O)nc2c([N+](=O)[O-])cc(Br)cc2c1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSV O60911 4/20 0.40
CTSL P07711 4/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PIN1 Q13526 2/20 0.39
MAPT P10636 2/20 0.39
PTGFR P43088 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGER1 P34995 1/20 0.38
CYP19A1 P11511 1/20 0.38
MYC P01106 1/20 0.37
MAX P61244 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL6080118 0.88 CTSV (0.40) CTSVCTSLMEN1KMT2APIN1
SCHEMBL6081258 0.85 CTSV (0.47) CTSVCTSLMEN1KMT2APIN1
SCHEMBL6080219 0.85 KMT2A (0.39) CTSVCTSLMEN1KMT2APIN1
SCHEMBL6080666 0.85 MEN1 (0.39) CTSVCTSLMEN1KMT2APIN1
SCHEMBL6080366 0.82 MAPT (0.41) CTSVCTSLKMT2AMAPTSMN1; SMN2
SCHEMBL6080327 0.82 SIRT6 (0.44) KMT2AMAPT
SCHEMBL6079966 0.81 KMT2A (0.40) CTSVCTSLMEN1KMT2APIN1
SCHEMBL6079944 0.81 XDH (0.42) PTGFRPTGER1
SCHEMBL6594175 0.81 CTSV (0.44) CTSVCTSLPIN1PTGER1CYP19A1
SCHEMBL6594169 0.81 CTSV (0.44) CTSVCTSLPIN1PTGER1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US claimed
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL CTSV 1695/4885CTSL 3040/4885MEN1 740/4885

“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.