SCHEMBL3469997

SCHEMBL3469997

[CH2]c1cccc(NC(=O)CN2CCN(CCCN(C)C)CC2)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
POLB P06746 1/20 0.51
HTR7 P34969 1/20 0.48
DRD4 P21917 3/20 0.46
DRD2 P14416 2/20 0.46
DRD3 P35462 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 1/20 0.45
KCNA5 P22460 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL3469739 0.91 L3MBTL1 (0.49) ALDH1A1HTR7SMN1; SMN2
SCHEMBL1355231 0.84 ALDH1A1 (0.64) ALDH1A1POLBDRD4DRD2DRD3
SCHEMBL3470382 0.81 ALDH1A1 (0.57) ALDH1A1POLBDRD4SMN1; SMN2KCNA5
SCHEMBL1356616 0.80 POLB (0.78) ALDH1A1POLBSMN1; SMN2HTTMEN1
SCHEMBL3472352 0.77 ALDH1A1 (0.58) ALDH1A1POLBDRD4DRD2DRD3
SCHEMBL1353693 0.77 ALDH1A1 (0.72) ALDH1A1POLBSMN1; SMN2HTTMEN1
SCHEMBL3469892 0.74 HTR1A (0.52) ALDH1A1POLBHTR7SMN1; SMN2
SCHEMBL1356705 0.73 MAP4K4 (0.48) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL3470248 0.73 TSHR (0.63) ALDH1A1POLBHTT
SCHEMBL3478037 0.73 CA12 (0.44) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-2191832-A1 QUINAZOLINE DERIVATIVES WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE Novartis AG (CH) 2010-06-02 EP disclosed
US-20040180912-A1 Quinazoline derivatives NOVARTIS AG (CH) 2004-09-16 US disclosed
EP-1401451-A2 QUINAZOLINE DERIVATIVES WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE Novartis AG (CH) 2004-03-31 EP disclosed
WO-2002102782-A2 QUINAZOLINE DERIVATIVES which PROMOTE THE RELEASE OF PARATHYROID_HORMONE NOVARTIS AG (CH) 2002-12-27 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-20040180912-A1 Quinazoline derivatives PTH1R, PTMS, CALCA ALDH1A1 2947/4885POLB 4649/4885HTR7 2128/4885

“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.