SCHEMBL6731942

SCHEMBL6731942

O=[N+]([O-])c1ccc(-c2cc(-c3ccc([N+](=O)[O-])cc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.60
▸ KMT2A Q03164 6/20 0.60
▸ ALDH1A1 P00352 4/20 0.60
▸ MAPT P10636 3/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ NPC1 O15118 3/20 0.59
▸ RAB9A P51151 3/20 0.59
▸ NTSR1 P30989 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ POLB P06746 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ ABCG2 Q9UNQ0 3/20 0.56
▸ ELANE P08246 1/20 0.56
▸ ABCB1 P08183 1/20 0.56
▸ ABCC1 P33527 1/20 0.56
▸ XBP1 P17861 1/20 0.55
▸ HTT P42858 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ THRB P10828 1/20 0.52
▸ MCL1 Q07820 1/20 0.52

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
SCHEMBL28489642 1.00 MEN1 (0.60) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL6727847 0.91 MEN1 (0.57) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL22604036 0.91 MAPK1 (0.62) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL15227091 0.88 MCL1 (0.61) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL4779395 0.86 KMT2A (0.67) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL6727635 0.86 RAB9A (0.64) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL14987897 0.84 MAPK1 (0.68) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL8211417 0.83 MEN1 (0.62) MEN1KMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL29769219 0.82 XDH (0.58) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL17367816 0.82 MEN1 (0.79) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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-20040110757-A1 Flt-1 ligands and their uses in the treatment of diseases regulatable by angiogenesis ARRHENIUS THOMAS (US) 2004-06-10 — — US disclosed
EP-1370250-A2 FLT-1 LIGANDS AND THEIR USES IN THE TREATMENT OF DISEASES REGULATABLE BY ANGIOGENESIS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-12-17 — — EP disclosed
WO-2002076438-A2 FLT-1 LIGANDS AND THEIR USES IN THE TREATMENT OF DISEASES REGULATABLE BY ANGIOGENESIS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-10-03 — — WO 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-20040110757-A1 Flt-1 ligands and their uses in the treatment of diseases regulatable by angiogenesis FLT1, FLT4, TEK MEN1 1965/4885KMT2A 2223/4885ALDH1A1 757/4885

“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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