SCHEMBL70363

SCHEMBL70363

O=C(O)c1ccc(-c2ccccn2)nc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
DHODH Q02127 2/20 0.50
KDM4E B2RXH2 6/20 0.49
KDM6B O15054 1/20 0.49
KDM4A O75164 1/20 0.49
KDM5C P41229 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
KDM2A Q9Y2K7 1/20 0.49
KDM3A Q9Y4C1 1/20 0.49
CCR1 P32246 3/20 0.48
CCR5 P51681 3/20 0.48
CCR8 P51685 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
TP53 P04637 2/20 0.48
ALOX15 P16050 2/20 0.48
HTT P42858 2/20 0.48
ALPL P05186 1/20 0.48
HSP90AA1 P07900 1/20 0.48
ALPI P09923 1/20 0.48

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
SCHEMBL70803 0.86 KDM4E (0.47) LMNASMN1; SMN2DHODHKDM4EKDM6B
SCHEMBL10900818 0.80 ALDH1A1 (0.64) LMNASMN1; SMN2DHODHKDM4EALDH1A1
SCHEMBL90998 0.79 LMNA (0.52) LMNASMN1; SMN2KDM4ETP53HTT
SCHEMBL4178497 0.76 DHODH (0.56) LMNASMN1; SMN2DHODHKDM4EKDM6B
SCHEMBL3757640 0.76 MEN1 (0.51) LMNASMN1; SMN2DHODHKDM4EKDM6B
SCHEMBL6795380 0.75 ALDH1A1 (0.52) LMNASMN1; SMN2DHODHKDM4EKDM6B
Dipyridyl SCHEMBL18601618 0.74 KDM4E (0.74) LMNASMN1; SMN2KDM4EKDM6BKDM4A
Dipyridyl SCHEMBL2792069 0.74 KDM4E (0.74) LMNASMN1; SMN2KDM4EKDM6BKDM4A
Dipyridyl SCHEMBL30976994 0.74 KDM4E (0.74) LMNASMN1; SMN2KDM4EKDM6BKDM4A
Dipyridyl SCHEMBL7773433 0.74 KDM4E (0.74) LMNASMN1; SMN2KDM4EKDM6BKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299066-B2 Compounds having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2012-10-30 US disclosed
US-8299066-B2 Compounds having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2012-10-30 US disclosed
US-20120130070-A1 COMPOUNDS HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-24 US disclosed
US-20120130070-A1 COMPOUNDS HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-05-24 US disclosed
US-8129372-B2 Compounds having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2012-03-06 US disclosed
US-8129372-B2 Compounds having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2012-03-06 US disclosed
US-20110028468-A1 COMPOUNDS HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY Shinonogi & Co., Ltd (JP) 2011-02-03 US disclosed
US-20110028468-A1 COMPOUNDS HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY Shinonogi & Co., Ltd (JP) 2011-02-03 US disclosed
EP-2280000-A1 COMPOUND HAVING NPY Y5 RECEPTOR ANTAGONIST ACTIVITY Shionogi&Co., Ltd. (JP) 2011-02-02 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 (2 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-20120130070-A1 COMPOUNDS HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY NPY5R, NPY1R, NPY2R LMNA 3493/4885SMN1; SMN2 2506/4885DHODH 4741/4885
US-20110028468-A1 COMPOUNDS HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY NPY5R, NPY1R, NPY2R LMNA 3493/4885SMN1; SMN2 2506/4885DHODH 4741/4885

“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.