SCHEMBL6226009

SCHEMBL6226009

O=C(O)c1ncoc1-c1ccc([N+](=O)[O-])cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 5/20 0.42
▸ RAB9A P51151 5/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ APEX1 P27695 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ NPC1 O15118 3/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MAPK1 P28482 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
SCHEMBL6221389 0.86 RAB9A (0.44) HSD17B10KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL6224673 0.83 ALDH1A1 (0.44) KMT2AMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL6224808 0.81 ALDH1A1 (0.46) KMT2AMAPTALDH1A1MEN1POLB
SCHEMBL4369750 0.81 ALPL (0.44) RAB9ASMN1; SMN2ALDH1A1TP53NPC1
SCHEMBL15946999 0.78 ADORA2A (0.49) KMT2AMAPTRAB9AALDH1A1POLB
SCHEMBL30395005 0.75 ADORA2A (0.47) KMT2AMAPTSMN1; SMN2ALDH1A1MEN1
SCHEMBL10405791 0.72 HSD17B10 (0.72) HSD17B10KMT2AMAPTALDH1A1MEN1
SCHEMBL6224124 0.72 HTT (0.47) KMT2AMAPTSMN1; SMN2ALDH1A1MEN1
SCHEMBL6224141 0.71 HTT (0.44) KMT2AMAPTSMN1; SMN2ALDH1A1MEN1
SCHEMBL19814272 0.70 NOTUM (0.53) HSD17B10KMT2AMAPTRAB9ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186598-B1 Process of preparing 5-(2-substituted-4-nitrophenyl)-oxazole, oxazole compound, and process of preparing the same NIPPON SYNTHETIC CHEM IND (JP) 2005-03-16 — — EP disclosed
US-6423849-B1 VIRICIDES; ANTICANCER AGENTS THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2002-07-23 — — US disclosed
US-20020035265-A1 Process of preparing 5-(2-substituted-4-nitrophenyl)-oxazole, novel oxazole compound, and process of preparing the same THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. 2002-03-21 — — US disclosed
EP-1186598-A1 Process of preparing 5-(2-substituted-4-nitrophenyl)-oxazole, oxazole compound, and process of preparing the same The Nippon Synthetic Chemical Industry Co., Ltd. (JP) 2002-03-13 — — 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 (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-20020035265-A1 Process of preparing 5-(2-substituted-4-nitrophenyl)-oxazole, novel oxazole compound, and process of preparing the same PNPO, OXA1L, ATIC HSD17B10 3233/4885KMT2A 1395/4885MAPT 2812/4885

“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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