SCHEMBL5888197

SCHEMBL5888197

COc1ccc(Cn2c(=O)ccc3cnc(Cl)cc32)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE1A P54750 1/20 0.47
▸ PDE1B Q01064 1/20 0.47
▸ PDE1C Q14123 1/20 0.47
▸ PDE5A O76074 5/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ CCR9 P51686 1/20 0.43
▸ KMT2A Q03164 2/20 0.42
▸ P2RX3 P56373 1/20 0.41
▸ YTHDC1 Q96MU7 1/20 0.41
▸ CCR2 P41597 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ IDE P14735 1/20 0.40
▸ NTSR1 P30989 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
SCHEMBL5888257 0.78 CDK4 (0.43) PDE1APDE1BPDE1CPDE5AALDH1A1
SCHEMBL5888334 0.78 PDE5A (0.48) PDE5A
SCHEMBL5888339 0.78 PDE5A (0.48) PDE5A
SCHEMBL16896798 0.76 KMT2A (0.47) PDE5AALDH1A1CCR9KMT2AP2RX3
SCHEMBL17119621 0.75 BTK (0.58) CCR9CDK4CCND1CCND2CCND3
SCHEMBL5888853 0.73 PDE5A (0.53) PDE5A
SCHEMBL23142089 0.72 BTK (0.46) PDE5ACCR9CDK4CCND1CCND2
SCHEMBL20373785 0.70 KMT2A (0.43) PDE1APDE1BPDE1CPDE5AALDH1A1
SCHEMBL5888000 0.70 PDE5A (0.55) PDE5A
SCHEMBL18326383 0.69 PDE5A (0.46) PDE5AALDH1A1KDM4ECCR9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7078522-B2 Pyridopyrimidine or naphthyridine derivative TANABE SEIYAKU CO., LTD. (JP) 2006-07-18 — — US disclosed
US-20050101615-A1 Pyridopyrimidine or naphthyridine derivative TANABE SEIYAKU CO., LTD. (JP) 2005-05-12 — — US disclosed
EP-1364950-A1 PYRIDOPYRIMIDINE OR NAPHTHYRIDINE DERIVATIVE TANABE SEIYAKU CO., LTD. (JP) 2003-11-26 — — 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 (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-20050101615-A1 Pyridopyrimidine or naphthyridine derivative PDE5A, PDE3B, PDE3A PDE1A 56/4885PDE1B 42/4885PDE1C 70/4885

“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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