SCHEMBL2218337

SCHEMBL2218337

O=C(c1ccccc1)N1CCC(Oc2ccccc2F)C1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ ATM Q13315 1/20 0.52
▸ HSD11B1 P28845 2/20 0.50
▸ PDE4B Q07343 1/20 0.49
▸ KMT2A Q03164 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ACHE P22303 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ SLC18A3 Q16572 1/20 0.46
▸ NAMPT P43490 1/20 0.45
▸ EPHX1 P07099 1/20 0.45
▸ L3MBTL3 Q96JM7 1/20 0.45
▸ HPGD P15428 1/20 0.44

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
SCHEMBL2218331 1.00 L3MBTL1 (0.54) L3MBTL1NPC1RAB9AATMHSD11B1
SCHEMBL5114227 0.88 HPGD (0.47) L3MBTL1KMT2AMEN1KDM4EHPGD
SCHEMBL2218213 0.83 HSD11B1 (0.47) L3MBTL1NPC1RAB9AHSD11B1KMT2A
SCHEMBL2217475 0.83 HSD11B1 (0.47) L3MBTL1NPC1RAB9AHSD11B1KMT2A
SCHEMBL2217471 0.83 HSD11B1 (0.47) L3MBTL1NPC1RAB9AHSD11B1KMT2A
SCHEMBL12442639 0.82 NAMPT (0.57) L3MBTL1PDE4BACHENAMPTEPHX1
SCHEMBL3825830 0.82 HPGD (0.49) L3MBTL1KDM4EHPGD
SCHEMBL27833294 0.80 HPGD (0.50) L3MBTL1HPGD
SCHEMBL2220012 0.79 ALDH1A1 (0.60) HSD11B1PDE4BACHEKDM4ESLC18A3
SCHEMBL2220004 0.79 ALDH1A1 (0.60) HSD11B1PDE4BACHEKDM4ESLC18A3

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-8785452-B2 Anti-infective compounds INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 2014-07-22 — — US disclosed
EP-2730576-A2 Anti-infective compounds Institut Pasteur Korea (KR) 2014-05-14 — — EP disclosed
US-20110178077-A1 Anti-infective compounds INSTITUT PASTEUR KOREA (KR) 2011-07-21 — — 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-20110178077-A1 Anti-infective compounds RABGGTB, ELANE, SERPINB1 L3MBTL1 643/4885NPC1 402/4885RAB9A 1091/4885

“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.

Send feedback