SCHEMBL10110872

SCHEMBL10110872

CC(C)(C)NCCCCNCCCN

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.62
CA6 P23280 5/20 0.62
CA7 P43166 5/20 0.62
CA9 Q16790 5/20 0.62
CA14 Q9ULX7 5/20 0.62
CA5B Q9Y2D0 5/20 0.62
CA2 P00918 4/20 0.62
CA4 P22748 4/20 0.62
CA5A P35218 4/20 0.62
CYP1A2 P05177 3/20 0.62
ALOX15 P16050 3/20 0.62
F13A1 P00488 2/20 0.62
THPO P40225 2/20 0.62
CASP2 P42575 2/20 0.62
MEN1 O00255 2/20 0.62
RECQL P46063 2/20 0.62
KMT2A Q03164 2/20 0.62
CYP2C19 P33261 2/20 0.62
HSD17B10 Q99714 1/20 0.62
CA3 P07451 3/20 0.59

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
SCHEMBL756934 0.98 CA12 (0.59) CA12CA6CA7CA9CA14
SCHEMBL861203 0.95 CA12 (0.55) CA12CA6CA7CA9CA14
SCHEMBL10110868 0.93 CA12 (0.56) CA12CA6CA7CA9CA14
SCHEMBL861102 0.93 CASP2 (0.59) CA12CA6CA7CA9CA14
SCHEMBL18827192 0.91 CASP2 (0.62) CA12CA6CA7CA9CA14
SCHEMBL989774 0.90
SCHEMBL21214219 0.88 CA12 (0.60) CA12CA6CA7CA9CA14
SCHEMBL10247635 0.87 CA12 (0.46) CA12CA6CA7CA9CA14
SCHEMBL21800043 0.85 CA12 (0.43) CA12CA6CA7CA9CA14
SCHEMBL21800028 0.85 CA12 (0.43) CA12CA6CA7CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9333232-B2 Methods for treating papilloma virus infection NANOVIR LLC (US) 2016-05-10 US disclosed
US-9333232-B2 Methods for treating papilloma virus infection NANOVIR LLC (US) 2016-05-10 US disclosed
US-9290551-B2 Compounds for treating papilloma virus infection NANOVIR LLC (US) 2016-03-22 US disclosed
US-20150239943-A1 COMPOUNDS FOR TREATING PAPILLOMA VIRUS INFECTION THE CURATORS OF THE UNIVERSITY OF MISSOURI 2015-08-27 US disclosed
US-8993609-B2 Compounds for treating papilloma virus infection NANOVIR, LLC (US) 2015-03-31 US disclosed
US-20120225809-A1 COMPOUNDS FOR TREATING PAPILLOMA VIRUS INFECTION NANOVIR, LLC (US) 2012-09-06 US disclosed
US-8119677-B2 Polyamides containing amino butyric acid-based building blocks NANOVIR, LLC (US) 2012-02-21 US disclosed
US-20100015084-A1 Compounds for Treating Papilloma Virus Infection NANOVIR, LLC (US) 2010-01-21 US disclosed
US-20090306164-A1 Methods for Treating Papilloma Virus Infection NANOVIR, LLC (US) 2009-12-10 US disclosed
US-7589171-B2 Polyamides for treating human papilloma virus NANOVIR, LLC (US) 2009-09-15 US disclosed
US-20070293417-A1 Polyamides for treating human papilloma virus NANOVIR, LLC 2007-12-20 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 (5 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-20120225809-A1 COMPOUNDS FOR TREATING PAPILLOMA VIRUS INFECTION POLI, TLR3, PMAIP1 CA12 168/4885CA6 633/4885CA7 299/4885
US-20090306164-A1 Methods for Treating Papilloma Virus Infection POLI, VHL, TLR3 CA12 45/4885CA6 392/4885CA7 125/4885
US-20150239943-A1 COMPOUNDS FOR TREATING PAPILLOMA VIRUS INFECTION POLI, TLR3, PMAIP1 CA12 168/4885CA6 633/4885CA7 299/4885
US-20100015084-A1 Compounds for Treating Papilloma Virus Infection POLI, PMAIP1, TLR3 CA12 285/4885CA6 911/4885CA7 392/4885
US-20070293417-A1 Polyamides for treating human papilloma virus POLI, PARG, PARN CA12 332/4885CA6 1131/4885CA7 598/4885

“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.