SCHEMBL915393

SCHEMBL915393

C[C@H](O)CN1CCCCCC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
MAPT P10636 2/20 0.52
ATM Q13315 2/20 0.52
HSD17B10 Q99714 2/20 0.47
ANPEP P15144 1/20 0.43
ERAP2 Q6P179 1/20 0.43
MAOB P27338 1/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
DRD3 P35462 4/20 0.42
CHRM2 P08172 2/20 0.42
ADRA2B P18089 2/20 0.42
SIGMAR1 Q99720 2/20 0.42
HRH3 Q9Y5N1 2/20 0.42
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 1/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL23163258 1.00 MEN1 (0.64) MEN1KMT2AMAPTATMHSD17B10
SCHEMBL16115683 1.00 MEN1 (0.64) MEN1KMT2AMAPTATMHSD17B10
SCHEMBL19947656 1.00 MEN1 (0.64) MEN1KMT2AMAPTATMHSD17B10
SCHEMBL862327 1.00 MEN1 (0.64) MEN1KMT2AMAPTATMHSD17B10
SCHEMBL14511330 1.00 MEN1 (0.64) MEN1KMT2AMAPTATMHSD17B10
SCHEMBL29025599 0.97 KMT2A (0.59) MEN1KMT2AMAPTATMHSD17B10
SCHEMBL65035 0.97
SCHEMBL19617353 0.97
SCHEMBL25299343 0.97
Hydrochloric Acid SCHEMBL8578344 0.95 KMT2A (0.56) MEN1KMT2AMAPTATMHSD17B10

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
US-8183366-B2 Chemokine receptor antagonists NOVARTIS AG (CH) 2012-05-22 US disclosed
US-20110015180-A1 Chemokine receptor antagonists NOVARTIS AG (CH) 2011-01-20 US disclosed
US-7858781-B2 Chemokine receptor antagonists NOVARTIS AG (CH) 2010-12-28 US disclosed
EP-1720859-B1 CHEMOKINE RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2009-12-23 EP disclosed
US-20070155721-A1 Chemokine receptor antagonists NOVARTIS AG (CH) 2007-07-05 US disclosed
EP-1720859-A2 CHEMOKINE RECEPTOR ANTAGONISTS Novartis AG (CH) 2006-11-15 EP disclosed
WO-2005077932-A2 CHEMOKINE RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2005-08-25 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-20110015180-A1 Chemokine receptor antagonists ACKR3, CXCR2, CXCR4 MEN1 3891/4885KMT2A 4109/4885MAPT 4746/4885
US-20070155721-A1 Chemokine receptor antagonists ACKR3, CXCR2, CXCR4 MEN1 3849/4885KMT2A 4125/4885MAPT 4722/4885

“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.