SCHEMBL7552469

SCHEMBL7552469

O=C1NN=CC1=CNc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ METAP1 P53582 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CA1 P00915 2/20 0.37
▸ MMP14 P50281 2/20 0.37
▸ CXCR2 P25025 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ TGM2 P21980 1/20 0.37
▸ CA2 P00918 2/20 0.36

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
SCHEMBL182888 0.67 ALDH1A1 (0.57) MAPTRAB9AALDH1A1RECQLHSD17B10
SCHEMBL20377071 0.66 ALDH1A1 (0.61) MAPTRAB9AALDH1A1RECQLHSD17B10
SCHEMBL6304694 0.66 ALDH1A1 (0.55) MAPTRAB9AALDH1A1RECQLHSD17B10
SCHEMBL11858122 0.66 TGM2 (0.58) MAPTRAB9AALDH1A1RECQLHSD17B10
SCHEMBL11409115 0.66 ALDH1A1 (0.55) MAPTRAB9AALDH1A1RECQLHSD17B10
SCHEMBL22056817 0.64 L3MBTL1 (0.51) MAPTRAB9AALDH1A1RECQLHSD17B10
Methyl Alcohol SCHEMBL27858597 0.63 ALDH1A1 (0.57) MAPTRAB9AALDH1A1RECQLHSD17B10
SCHEMBL7549357 0.63 CA1 (0.37) MAPTRAB9AALDH1A1MEN1KMT2A
SCHEMBL11592121 0.63 ALDH1A1 (0.61) MAPTALDH1A1RECQLHSD17B10MEN1
SCHEMBL6242879 0.63 ALDH1A1 (0.61) MAPTALDH1A1RECQLHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020058244-A1 Method for detecting uracil biosynthesis inhibitors and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2002-05-16 — — US claimed

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-20020058244-A1 Method for detecting uracil biosynthesis inhibitors and their use as herbicides UMPS, UGP2, UNG MAPT 2062/4885RAB9A 4202/4885ALDH1A1 484/4885

“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.

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