SCHEMBL6366909

SCHEMBL6366909

COc1ccc(OC)c(Cc2nc3c(C4CCCC4)n[nH]c3c(=O)[nH]2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.43
▸ HSP90AB1 P08238 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.38
▸ HTT P42858 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ ELANE P08246 1/20 0.37
▸ PDE7A Q13946 2/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ CDC7 O00311 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ PDE9A O76083 3/20 0.35
▸ ALPL P05186 1/20 0.35

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
SCHEMBL6365889 0.87 PNP (0.44) PDE7AATMPDE9A
SCHEMBL6371909 0.80 HSP90AA1 (0.46) HSP90AA1HSP90AB1KDM4EHTTSMN1; SMN2
SCHEMBL6366854 0.78 CCR2 (0.39) PDE9A
SCHEMBL6374090 0.78 PDE1A (0.48) PDE7APDE9A
SCHEMBL6366302 0.78 PDE1A (0.41) KDM4EPTGDR2PDE9A
SCHEMBL6367367 0.77 CXCR2 (0.32) ADORA1
SCHEMBL6365904 0.76 NR3C1 (0.41) KDM4EHTTPDE9A
SCHEMBL6371780 0.76 PLA2G2A (0.43) HTTSMN1; SMN2RAB9AALDH1A1HPGD
SCHEMBL3492585 0.76 PDE1A (0.56) PDE9A
SCHEMBL6366319 0.76 KDM4E (0.48) KDM4EHTTSMN1; SMN2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6967204-B2 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC (US) 2005-11-22 — — US disclosed
US-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC 2005-03-31 — — US 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-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors GPR119, PDE2A, PDE9A HSP90AA1 2757/4885HSP90AB1 2350/4885KDM4E 1823/4885

“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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