SCHEMBL7172524

SCHEMBL7172524

O=C(NCc1ccncc1)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 6/20 0.53
▸ PDE4A P27815 5/20 0.53
▸ CCR1 P32246 1/20 0.52
▸ KMT2A Q03164 1/20 0.48
▸ CNR1 P21554 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ STAT3 P40763 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ MAPT P10636 1/20 0.45

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
SCHEMBL7172514 0.93 PDE4A (0.60) KCNH2PDE4AKMT2ACNR1L3MBTL1
SCHEMBL7171214 0.90 KCNH2 (0.54) KCNH2PDE4A
SCHEMBL7169618 0.87 PDE4A (0.55) KCNH2PDE4AL3MBTL1
SCHEMBL7688432 0.85 PDE4A (0.55) KCNH2PDE4A
SCHEMBL7174514 0.85 KCNH2 (0.60) KCNH2PDE4AKMT2ATP53MAPT
SCHEMBL7169759 0.85 PDE4A (0.62) KCNH2PDE4AKMT2A
SCHEMBL7172789 0.84 PDE4A (0.57) KCNH2PDE4ACNR1MAPT
SCHEMBL7167992 0.84 PDE4A (0.53) KCNH2PDE4A
SCHEMBL7167745 0.84 PDE4A (0.53) KCNH2PDE4ATP53MAPT
SCHEMBL7171340 0.84 PDE4A (0.71) KCNH2PDE4A

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-6541480-B2 Controlling cytokines SUNTORY LIMITED (JP) 2003-04-01 — — US disclosed
US-20020006935-A1 1-aryl-1,8-naphthylidin-4-one derivative as type IV phosphodiesterase inhibitor DAIICHI ASUBIO PHARMA CO., LTD. (JP) 2002-01-17 — — US disclosed
US-6297248-B1 1-aryl-1,8-naphthylidin-4-one derivative as type IV phosphodiesterase inhibitor SUNTORY LIMITED (JP) 2001-10-02 — — 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-20020006935-A1 1-aryl-1,8-naphthylidin-4-one derivative as type IV phosphodiesterase inhibitor PDE3A, PDE5A, PDE3B KCNH2 559/4885PDE4A 4/4885CCR1 1937/4885

“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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