SCHEMBL17366185

SCHEMBL17366185

O=C1c2ccccc2C(c2ccccc2)N1Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
POLB P06746 2/20 0.52
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA9 Q16790 1/20 0.49
MDM2 Q00987 4/20 0.47
MMP2 P08253 1/20 0.46
APP P05067 2/20 0.45
MAPT P10636 2/20 0.45
SNCA P37840 2/20 0.45
TRPV6 Q9H1D0 1/20 0.45

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
SCHEMBL17366148 0.91 CYP2C9 (0.57) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL17366158 0.90 CYP2C9 (0.56) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL17366155 0.90 CYP2C9 (0.56) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL8274847 0.85 MEN1 (0.55) KMT2AMEN1MDM2MAPT
SCHEMBL31667491 0.83 CYP2C9 (0.65) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL17366195 0.81 CYP2C9 (0.52) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL10997735 0.80 CA2 (0.57) CA12CA1CA9MDM2
SCHEMBL30121977 0.78 MDM2 (0.64) KMT2AMEN1CA12CA1CA9
SCHEMBL17366153 0.76 MDM2 (0.52) CYP2C9CYP2C19KMT2AMEN1POLB
SCHEMBL17366164 0.76 MDM2 (0.53) CYP2C9CYP2C19KMT2AMEN1POLB

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-10414726-B2 Therapeutic agents CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-09-17 US disclosed
US-20180118684-A1 THERAPEUTIC AGENTS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-05-03 US disclosed
EP-2960233-A1 NEW THERAPEUTIC AGENTS Cancer Research Technology Limited (GB) 2015-12-30 EP 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 (2 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-20180118684-A1 THERAPEUTIC AGENTS TP53, MDM2, TP53BP1 CYP2C9 3751/4885CYP2C19 3456/4885KMT2A 4165/4885
US-10414726-B2 Therapeutic agents TP53, MDM2, TP53BP1 CYP2C9 3751/4885CYP2C19 3456/4885KMT2A 4165/4885

“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.