SCHEMBL10110841

SCHEMBL10110841

Cn1cnc2ccc(C(=O)C(C)(C)C)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.46
DYRK1A Q13627 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
HSD11B1 P28845 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
FGFR1 P11362 1/20 0.42
TNKS O95271 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
NOTUM Q6P988 2/20 0.40
MLLT1 Q03111 1/20 0.40
NAMPT P43490 1/20 0.40
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38

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
SCHEMBL12664208 0.88 ALDH1A1 (0.52) NPC1RAB9ATP53SMN1; SMN2KMT2A
SCHEMBL29819602 0.82 ALDH1A1 (0.53) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL16602284 0.82 ALDH1A1 (0.53) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL1869730 0.82 FGFR1 (0.60) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL11171 0.81 SMN1; SMN2 (0.50) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL20570515 0.81 CHRNA7 (0.47) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL29555125 0.78 FGFR1 (0.53) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL3492748 0.78 FGFR1 (0.53) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL12094844 0.78 SMN1; SMN2 (0.48) CHRNA7DYRK1ANPC1RAB9ATP53
SCHEMBL3491023 0.77 CHRNA7 (0.53) CHRNA7DYRK1ANPC1RAB9ATP53

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 10 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-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 CHRNA7 4762/4885DYRK1A 4773/4885NPC1 394/4885
US-20090306164-A1 Methods for Treating Papilloma Virus Infection POLI, VHL, TLR3 CHRNA7 4666/4885DYRK1A 4657/4885NPC1 1816/4885
US-20150239943-A1 COMPOUNDS FOR TREATING PAPILLOMA VIRUS INFECTION POLI, TLR3, PMAIP1 CHRNA7 4762/4885DYRK1A 4773/4885NPC1 394/4885
US-20100015084-A1 Compounds for Treating Papilloma Virus Infection POLI, PMAIP1, TLR3 CHRNA7 4814/4885DYRK1A 4725/4885NPC1 583/4885
US-20070293417-A1 Polyamides for treating human papilloma virus POLI, PARG, PARN CHRNA7 4630/4885DYRK1A 3982/4885NPC1 2740/4885

“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.