SCHEMBL3634951

SCHEMBL3634951

CC(C)(CN)N1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
CYP2B6 P20813 1/20 0.32
NPC1 O15118 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL3635466 0.97 CYP2B6 (0.35) CYP2D6CYP2B6NPC1
SCHEMBL19101444 0.88
SCHEMBL6367927 0.88 CYP2D6 (0.37) CYP2D6HTT
SCHEMBL3912391 0.79 NPC1 (0.32) CYP2B6NPC1
SCHEMBL3902738 0.79 NCF1 (0.36) CYP2D6
SCHEMBL28274322 0.77 GAA (0.30)
SCHEMBL482260 0.77 ALDH1A1 (0.37) HTT
SCHEMBL24663779 0.77 CYP2B6 (0.34) CYP2B6NPC1
SCHEMBL29214439 0.75 HTT (0.34) NPC1HTT
SCHEMBL178517 0.74 CYP2B6 (0.33) CYP2B6NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019046148-A1 MULTIPLE TRIGGER MONOMER CONTAINING PHOTORESIST COMPOSITIONS AND METHOD ROBINSON ALEX PHILLIP GRAHAM (GB) 2019-03-07 WO disclosed
US-20120142685-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-06-07 US disclosed
EP-2144909-A1 [2, 6]NAPHTHYRIDINES USEFUL AS PROTEIN KINASE INHIBITORS Novartis Ag (CH) 2010-01-20 EP disclosed
WO-2008122615-A1 [2, 6] NAPHTHYRIDINES USEFUL AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2008-10-16 WO disclosed
EP-0656353-B1 Aminochinoline derivates useful in the treatment of malaria HOFFMANN LA ROCHE (CH) 1998-06-03 EP disclosed
US-5596002-A TREATMENT OF ANTIBIOTIC RESISTANT MICROORGANISMS HOFFMANN-LA ROCHE INC. (US) 1997-01-21 US disclosed
EP-0656353-A1 Aminochinoline derivates useful in the treatment of malaria F. HOFFMANN-LA ROCHE AG (CH) 1995-06-07 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-20120142685-A1 ORGANIC COMPOUNDS MARK1, PKN1, MARK2 CYP2D6 3856/4885CYP2B6 4114/4885NPC1 3089/4885

“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.