SCHEMBL14908526

SCHEMBL14908526

CN1Cc2cnccc2CO1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.41
TIPARP Q7Z3E1 2/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
FAAH O00519 1/20 0.34
NAMPT P43490 6/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32

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
SCHEMBL14908532 0.92 SIGMAR1 (0.41) SIGMAR1TIPARPCHRNB2CHRNA4FAAH
SCHEMBL13976198 0.79 SIGMAR1 (0.36) SIGMAR1TIPARPCHRNB2CHRNA4PDE3B
SCHEMBL13966518 0.79 SIGMAR1 (0.36) SIGMAR1TIPARPCHRNB2CHRNA4PDE3B
SCHEMBL256354 0.75 SIGMAR1 (0.46) SIGMAR1TIPARPCHRNB2CHRNA4NAMPT
SCHEMBL14769042 0.73 MAOA (0.46)
SCHEMBL13966519 0.72 SIGMAR1 (0.36) SIGMAR1TIPARPCHRNB2CHRNA4NAMPT
SCHEMBL15462822 0.72 SIGMAR1 (0.36) SIGMAR1TIPARPCHRNB2CHRNA4NAMPT
SCHEMBL9965909 0.71 MAOA (0.55) SIGMAR1CHRNB2CHRNA4
SCHEMBL16298139 0.70 SIGMAR1 (0.50) SIGMAR1TIPARPCHRNB2CHRNA4PDE3B
SCHEMBL147460 0.70

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
EP-2770977-B1 NOVEL DOSAGE FORM NEUROVIVE PHARMACEUTICAL AB (SE) 2017-07-12 EP disclosed
US-9504728-B2 Dosage form NEUROVIVE PHARMACEUTICAL AB (SE) 2016-11-29 US disclosed
US-9139613-B2 Macrocyclic compounds and methods for their production NEUROVIVE PHARMACEUTICAL AB (SE) 2015-09-22 US disclosed
US-9119853-B2 Sanglifehrin based compounds NEUROVIVE PHARMACEUTICAL AB (SE) 2015-09-01 US disclosed
EP-2533784-B1 SANGLIFEHRIN BASED COMPOUNDS NEUROVIVE PHARMACEUTICAL AB (SE) 2015-04-22 EP disclosed
US-20140234414-A1 Novel Dosage Form Abliva Ab (SE) 2014-08-21 US disclosed
US-20140038885-A1 Macrocyclic Compounds and Methods for Their Production NEUROVIVE PHARMACEUTICAL AB (SE) 2014-02-06 US disclosed
WO-2013061052-A1 NOVEL DOSAGE FORM BIOTICA TECHNOLOGY LIMITED (GB) 2013-05-02 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 (2 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-20140234414-A1 Novel Dosage Form SI, RAB10, SAMM50 SIGMAR1 2125/4885TIPARP 1256/4885CHRNB2 4740/4885
US-20140038885-A1 Macrocyclic Compounds and Methods for Their Production HAVCR2, RPL35, CD4 SIGMAR1 3849/4885TIPARP 1683/4885CHRNB2 4877/4885

“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.