SCHEMBL3472352

SCHEMBL3472352

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
POLB P06746 2/20 0.57
ANXA2 P07355 1/20 0.53
S100A10 P60903 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.50
HTT P42858 1/20 0.49
DRD4 P21917 2/20 0.47
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
HPGD P15428 1/20 0.47
MAPT P10636 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C19 P33261 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL1356616 0.85 POLB (0.78) ALDH1A1POLBSMN1; SMN2HTTHPGD
SCHEMBL1355231 0.84 ALDH1A1 (0.64) ALDH1A1POLBSMN1; SMN2HTTDRD4
SCHEMBL1353693 0.82 ALDH1A1 (0.72) ALDH1A1POLBSMN1; SMN2HTTHPGD
SCHEMBL3470382 0.79 ALDH1A1 (0.57) ALDH1A1POLBSMN1; SMN2DRD4MAPT
SCHEMBL3469997 0.77 ALDH1A1 (0.55) ALDH1A1POLBSMN1; SMN2HTTDRD4
SCHEMBL6893687 0.72 ALDH1A1 (0.79) ALDH1A1POLBSMN1; SMN2KDM4ELMNA
SCHEMBL14622199 0.72 ALDH1A1 (0.66) ALDH1A1POLBANXA2S100A10SMN1; SMN2
SCHEMBL21085330 0.72 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2MAPTCYP1A2
SCHEMBL3695979 0.71 ALDH1A1 (0.64) ALDH1A1POLBSMN1; SMN2CYP2C19KDM4E
SCHEMBL7362634 0.70 CA1 (0.60) ALDH1A1POLBHPGDMAPTKDM4E

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 4649/4885ANXA2 2108/4885

“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.