SCHEMBL3469784

SCHEMBL3469784

O=c1nc(-c2ccccc2)c2cc([N+](=O)[O-])ccc2n1Cc1cccs1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 4/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ KMT2A Q03164 5/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.41
▸ POLB P06746 2/20 0.41
▸ MAPT P10636 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ HPGD P15428 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ USP2 O75604 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CASP1 P29466 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40

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
SCHEMBL3471111 0.85 L3MBTL1 (0.55) CFTRL3MBTL1KMT2AOPRK1ALOX5
SCHEMBL11550177 0.84 L3MBTL1 (0.52) CFTRL3MBTL1KMT2AOPRK1MAPT
SCHEMBL11543420 0.84 L3MBTL1 (0.50) CFTRL3MBTL1KMT2AOPRK1ALDH1A1
SCHEMBL3470351 0.82 CFTR (0.57) CFTRL3MBTL1KMT2AOPRK1ALDH1A1
SCHEMBL11604828 0.82 KMT2A (0.60) CFTRL3MBTL1KMT2AOPRK1ALDH1A1
SCHEMBL11159597 0.80 L3MBTL1 (0.53) CFTRL3MBTL1KMT2AOPRK1ALDH1A1
SCHEMBL11540068 0.80 L3MBTL1 (0.50) CFTRL3MBTL1KMT2AOPRK1ALDH1A1
SCHEMBL3472479 0.80 CFTR (0.56) CFTRL3MBTL1KMT2AOPRK1ALDH1A1
SCHEMBL11167732 0.80 MAPT (0.61) L3MBTL1KMT2AOPRK1ALDH1A1POLB
SCHEMBL11160397 0.80 L3MBTL1 (0.57) CFTRL3MBTL1KMT2AOPRK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2191832-A1 QUINAZOLINE DERIVATIVES WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE Novartis AG (CH) 2010-06-02 — — EP claimed
CN-101559062-A Quinazoline derivatives which promote the release of parathyroid hormone NOVARTIS AG (CH) 2009-10-21 — — CN claimed
US-20040180912-A1 Quinazoline derivatives NOVARTIS AG (CH) 2004-09-16 — — US claimed
CN-1516587-A Quinazoline derivatives capable of promoting release of parathyroid hormone ��˹��ŵ�� 2004-07-28 — — CN claimed
EP-1401451-A2 QUINAZOLINE DERIVATIVES WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE Novartis AG (CH) 2004-03-31 — — EP claimed
WO-2002102782-A2 QUINAZOLINE DERIVATIVES which PROMOTE THE RELEASE OF PARATHYROID_HORMONE NOVARTIS AG (CH) 2002-12-27 — — WO claimed
US-4146717-A NITROQUINAZOLINONE COMPOUNDS HAVING ANTIVIRAL PROPERTIES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-03-27 — — US claimed
US-8476286-B2 for promoting the release of parathyroid hormone, e.g. for preventing or treating bone conditions which are associated with increased calcium depletion or resorption or in which stimulation of bone formation and calcium fixation in the bone is desirable NOVARTIS AG (CH) 2013-07-02 — — US disclosed
CN-101559062-A Quinazoline derivatives which promote the release of parathyroid hormone NOVARTIS AG (CH) 2009-10-21 — — CN disclosed
US-20040180912-A1 Quinazoline derivatives NOVARTIS AG (CH) 2004-09-16 — — US disclosed
CN-1516587-A Quinazoline derivatives capable of promoting release of parathyroid hormone ��˹��ŵ�� 2004-07-28 — — CN disclosed
US-4146717-A NITROQUINAZOLINONE COMPOUNDS HAVING ANTIVIRAL PROPERTIES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-03-27 — — US disclosed
US-3953446-A Process for preparing quinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-27 — — 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 (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-20040180912-A1 Quinazoline derivatives PTH1R, PTMS, CALCA CFTR 2853/4885L3MBTL1 4552/4885KMT2A 3248/4885

“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.

Send feedback