SCHEMBL3976915

SCHEMBL3976915

C1CCC2[N]CCCN2CC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
HTR6 P50406 1/20 0.30
CHRM5 P08912 1/20 0.30
ADRA2C P18825 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
SCHEMBL8640560 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL2229452 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL6050828 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL4712511 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL8640554 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL286072 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL2569149 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL10891279 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL3658217 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6
SCHEMBL3558101 0.95 CYP2D6 (0.32) CYP2D6MEN1KMT2ALMNAHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252784-B2 Photoactivable nitrogen bases BASF SE (DE) 2012-08-28 US disclosed
US-7538104-B2 Photoactivable nitrogen bases CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-05-26 US disclosed
US-20090076200-A1 Letter with continuation application BAUDIN GISELE 2009-03-19 US disclosed
EP-1436297-B1 PHOTOACTIVABLE NITROGEN BASES CIBA SC HOLDING AG (CH) 2007-04-25 EP disclosed
US-20040242867-A1 Photoactivable nitrogen bases CIBA CORPORATION 2004-12-02 US disclosed
EP-1436297-A1 PHOTOACTIVABLE NITROGEN BASES Ciba Specialty Chemicals Holding Inc. (CH) 2004-07-14 EP disclosed
US-6583133-B1 Especially against Gram-positive organisms, e.g. methicillin-sensitive (MSSA) and methicillin- resistant (MRSA) staphylococci, enterococci and pneumococci BASILEA PHARMACEUTICA AG (CH) 2003-06-24 US disclosed
WO-2003033500-A1 PHOTOACTIVABLE NITROGEN BASES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-04-24 WO 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-20040242867-A1 Photoactivable nitrogen bases CBR3, NR2E3, RCOR3 CYP2D6 665/4885MEN1 4688/4885KMT2A 3529/4885

“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.