SCHEMBL6420054

SCHEMBL6420054

c1c[nH]c(Cc2cnc3ccccc3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 14/20 0.43
▸ CYP1A2 P05177 2/20 0.42
▸ PDGFRB P09619 2/20 0.41
▸ PDGFRA P16234 2/20 0.41
▸ KDM1A O60341 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 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
SCHEMBL10440683 0.80 DAO (0.51) PDE10A
Quinoline SCHEMBL27483163 0.77 ALDH1A1 (0.52) —
SCHEMBL6933468 0.76 PDGFRB (0.53) PDE10ACYP1A2PDGFRBPDGFRAKDM1A
SCHEMBL3396692 0.74 CYP1A2 (0.55) PDE10ACYP1A2PDGFRBPDGFRAKDM1A
Dimethylamine SCHEMBL7748841 0.73 PDE10A (0.52) PDE10ACYP1A2PDGFRBPDGFRAKDM1A
SCHEMBL10673413 0.73 CYP1A2 (0.50) PDE10ACYP1A2PDGFRBPDGFRAKDM1A
SCHEMBL1772519 0.71 BIRC5 (0.47) PDE10ACYP1A2PDGFRBPDGFRAKDM1A
SCHEMBL30644247 0.71 CYP1A2 (0.58) PDE10ACYP1A2PDGFRBPDGFRA
SCHEMBL701411 0.71 ALDH1A1 (0.53) PDE10ACYP1A2PDGFRBPDGFRAKDM1A
SCHEMBL5700742 0.71 CYP1A2 (0.52) PDE10ACYP1A2PDGFRBPDGFRAKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050227978-A1 Fibrosis inhibitor SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2005-10-13 — — US disclosed
EP-1479384-A1 FIBROSIS INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-11-24 — — EP disclosed
US-20040209939-A1 Pyrrole derivatives SUMITOMO PHARMACEUTICALS CO., LTD. 2004-10-21 — — US disclosed
US-6759429-B2 HAVING TRANSFORMING GROWTH FACTOR- BETA INHIBITORY ACTIVITY AND BEING USEFUL AS FIBROSIS INHIBITORS FOR ORGANS OR TISSUES SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2004-07-06 — — US disclosed
CN-1466572-A Pyrrole derivatives ס����ҩ��ʽ���� 2004-01-07 — — CN disclosed
US-20030181496-A1 Pyrrole derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2003-09-25 — — US disclosed
EP-1310485-A1 PYRROLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-05-14 — — 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 (3 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-20050227978-A1 Fibrosis inhibitor SMAD3, MMP1, SMAD2 PDE10A 3702/4885CYP1A2 654/4885PDGFRB 35/4885
US-20030181496-A1 Pyrrole derivatives NCOA1, PKD1, NR3C2 PDE10A 3656/4885CYP1A2 273/4885PDGFRB 131/4885
US-20040209939-A1 Pyrrole derivatives NCOA1, PKD1, NCOR1 PDE10A 3654/4885CYP1A2 250/4885PDGFRB 154/4885

“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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