SCHEMBL2918315

SCHEMBL2918315

COc1cc2nc(Cl)nc(N3CCN(C(=O)OC(C)(C)C)CC3)c2cc1OC

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TLR9 Q9NR96 5/20 0.66
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ ALDH1A1 P00352 1/20 0.63
▸ TLR7 Q9NYK1 2/20 0.61
▸ NSD2 O96028 1/20 0.52
▸ ACHE P22303 1/20 0.50
▸ BACE1 P56817 1/20 0.50
▸ KMT5A Q9NQR1 1/20 0.49
▸ EHMT2 Q96KQ7 2/20 0.48
▸ NTSR1 P30989 3/20 0.48
▸ PDGFRB P09619 2/20 0.48
▸ KDM1A O60341 1/20 0.47
▸ RCOR1 Q9UKL0 1/20 0.47
▸ PDGFRA P16234 1/20 0.47
▸ DNMT3A Q9Y6K1 1/20 0.47

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
SCHEMBL19405155 0.91 TLR9 (0.59) TLR9SMN1; SMN2ALDH1A1TLR7NSD2
SCHEMBL19405156 0.88 TLR9 (0.80) TLR9SMN1; SMN2ALDH1A1TLR7ACHE
SCHEMBL15820138 0.85 NTSR1 (0.68) TLR9ALDH1A1TLR7NSD2NTSR1
SCHEMBL22028788 0.83 TLR9 (0.52) TLR9SMN1; SMN2ALDH1A1TLR7BACE1
SCHEMBL16636524 0.83 TLR9 (0.52) TLR9SMN1; SMN2ALDH1A1TLR7BACE1
SCHEMBL30346732 0.83 TLR9 (0.52) TLR9SMN1; SMN2ALDH1A1TLR7BACE1
SCHEMBL2923197 0.83 TLR9 (0.66) TLR9SMN1; SMN2ALDH1A1TLR7ACHE
SCHEMBL4013403 0.82 GBA1 (0.51) TLR9SMN1; SMN2TLR7
SCHEMBL22220606 0.82 TLR9 (0.50) TLR9SMN1; SMN2TLR7
SCHEMBL30065068 0.82 TLR9 (0.50) TLR9SMN1; SMN2TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882717-B1 NITROGENOUS HETEROCYCLIC COMPOUNDS KYOWA HAKKO KIRIN CO LTD (JP) 2010-09-08 — — EP disclosed
CN-1169795-C Nitrogenous heterocyclic compounds Э�ͷ��͹�ҵ��ʽ���� 2004-10-06 — — CN disclosed
US-6750218-B2 INHIBITORY ACTIVITY ON PHOSPHORYLATION OF PLATELET-DERIVED GROWTH FACTOR (PDGF) RECEPTOR USEFUL FOR THE TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS MILLENNIUMIUM PHARMACEUTICALS, INC. 2004-06-15 — — US disclosed
US-20030229077-A1 Nitrogen-containing heterocyclic compounds MATSUNO KENJI (JP) 2003-12-11 — — US disclosed
US-6472391-B2 INHIBIT PHOSPHORYLATION OF PDGF RECEPTOR TO HINDER ABNORMAL CELL GROWTH AND CELL WANDERING; TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS. MILLENNIUM PHARMACEUTICALS, INC. 2002-10-29 — — US disclosed
US-20020068734-A1 Nitrogen-containing heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. 2002-06-06 — — US disclosed
US-6207667-B1 USEFUL FOR THE TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-03-27 — — US disclosed
US-6169088-B1 FOR THE PREVENTION OR TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-01-02 — — US disclosed
CN-1208404-A Nitrogenous heterocyclic compounds KYOWA HAKKO KOGYO KK (JP) 1999-02-17 — — CN disclosed
EP-0882717-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 — — 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-20030229077-A1 Nitrogen-containing heterocyclic compounds ERBB4, NPR1, PDGFRB TLR9 3444/4885SMN1; SMN2 3739/4885ALDH1A1 3252/4885
US-20020068734-A1 Nitrogen-containing heterocyclic compounds PDGFRB, MKI67, PDGFRA TLR9 3520/4885SMN1; SMN2 3955/4885ALDH1A1 3314/4885

“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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