SCHEMBL3873919

SCHEMBL3873919

O=C(O)CCCCc1ccc2[nH]c(-c3ccc(Cl)s3)nc2c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 1/20 0.45
▸ PDE3B Q13370 1/20 0.45
▸ PDE3A Q14432 1/20 0.45
▸ P2RY12 Q9H244 1/20 0.45
▸ F10 P00742 14/20 0.43
▸ FFAR1 O14842 1/20 0.38
▸ LTB4R Q15722 1/20 0.38

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
SCHEMBL3861744 0.85 F10 (0.47) F10
SCHEMBL8346292 0.80 F10 (0.43) F10
SCHEMBL8344662 0.78 KDM4E (0.40) F10
SCHEMBL3863014 0.77 CSNK2A2 (0.49) F10
SCHEMBL13759438 0.76 F10 (0.43) F10
SCHEMBL8346713 0.76 F10 (0.47) PDE2APDE3BPDE3AP2RY12F10
SCHEMBL8347891 0.75 L3MBTL1 (0.47) F10
SCHEMBL4687144 0.74 F10 (0.40) F10
SCHEMBL8344703 0.71 ALDH1A1 (0.46) F10
SCHEMBL8348316 0.70 F10 (0.43) F10

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-7566789-B2 Benzimidazole derivatives MERCK PATENT GMBH (DE) 2009-07-28 — — US disclosed
US-20050272740-A1 Benzimidazole derivatives MERCK PATENT GMBH (DE) 2005-12-08 — — 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-20050272740-A1 Benzimidazole derivatives F12, F11, SERPINC1 PDE2A 2107/4885PDE3B 1410/4885PDE3A 1383/4885

“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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