SCHEMBL9890762

SCHEMBL9890762

NC(=O)Cc1ccc([N+](=O)[O-])cc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.54
POLB P06746 3/20 0.49
RAB9A P51151 1/20 0.49
CYP1A2 P05177 3/20 0.49
PTGS2 P35354 2/20 0.47
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
PLA2G2A P14555 1/20 0.45
MAPK1 P28482 1/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.43
ELANE P08246 1/20 0.42
PTPRC P08575 2/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL9890664 0.88 CYP1A2 (0.63) PTGDR2POLBRAB9ACYP1A2PTGS2
SCHEMBL2397953 0.82 GAA (0.43) RAB9ACYP1A2PLA2G2AMAPK1MEN1
SCHEMBL5106325 0.79 PTGDR2 (0.48) PTGDR2POLBRAB9ACYP1A2PTGS2
SCHEMBL4268964 0.79 PTGDR2 (0.52) PTGDR2POLBRAB9ACYP1A2PTGS2
SCHEMBL5864351 0.78 ALDH1A1 (0.55) CYP1A2MAPK1MEN1KMT2AALDH1A1
SCHEMBL27958260 0.78 KMT2A (0.58) PTGDR2POLBRAB9ACYP1A2PTGS2
SCHEMBL11396189 0.78 PTGDR2 (0.58) PTGDR2POLBRAB9APTGS2MYC
SCHEMBL11597118 0.77 CYP1A2 (0.73) CYP1A2MAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4988275 0.77 CYP1A2 (0.55) CYP1A2MAPK1MEN1KMT2AALDH1A1
SCHEMBL19212217 0.77 PTGDR2 (0.51) PTGDR2POLBRAB9APTGS2MYC

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-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-06-07 US disclosed
EP-2374790-A1 BIPHENYLACETAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2011-10-12 EP disclosed
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-15 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 (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-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE HRH3, KCNH3, BRPF3 PTGDR2 1062/4885POLB 4657/4885RAB9A 208/4885
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE HRH3, KCNH3, BRPF3 PTGDR2 1062/4885POLB 4657/4885RAB9A 208/4885

“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.