SCHEMBL5528087

SCHEMBL5528087

CCc1sc(Nc2nc(NCc3ccc(OC)c(OC)c3)c3c(ncn3CC)n2)nc1C

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.75
PDE3A Q14432 3/20 0.75
PDE2A O00408 2/20 0.75
PDE5A O76074 3/20 0.69
TLR7 Q9NYK1 4/20 0.40
BCHE P06276 3/20 0.40
ACHE P22303 3/20 0.40
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
APP P05067 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TNF P01375 1/20 0.36
NOD1 Q9Y239 1/20 0.36

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
SCHEMBL6319303 0.86 PDE3B (1.00) PDE3BPDE3APDE2APDE5AGAA
SCHEMBL15307336 0.82 PDE3B (0.75) PDE3BPDE3APDE2APDE5AGAA
SCHEMBL6323438 0.80 PDE3B (0.90) PDE3BPDE3APDE2APDE5AGAA
SCHEMBL6318018 0.80 PDE3B (0.87) PDE3BPDE3APDE2APDE5ATLR7
SCHEMBL6325377 0.77 PDE3B (0.84) PDE3BPDE3APDE2APDE5AGAA
SCHEMBL6325399 0.74 PDE3B (0.67) PDE3BPDE3APDE2APDE5AACHE
SCHEMBL6318287 0.73 PDE3B (0.79) PDE3BPDE3APDE2APDE5AGAA
SCHEMBL6319496 0.73 PDE3B (0.78) PDE3BPDE3APDE2APDE5ANPC1
SCHEMBL17807525 0.73 PDE3B (0.53) PDE3BPDE3APDE2APDE5A
SCHEMBL6319424 0.73 PDE3B (0.77) PDE3BPDE3APDE2APDE5AGAA

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-20160158247-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2016-06-09 US disclosed
US-20160015715-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS OMEROS CORPORATION 2016-01-21 US disclosed
US-9220715-B2 Treatment of addiction and impulse-control disorders using PDE7 inhibitors OMEROS CORPORATION (US) 2015-12-29 US disclosed
US-9119822-B2 Use of PDE7 inhibitors for the treatment of movement disorders OMEROS CORPORATION (US) 2015-09-01 US disclosed
US-20140179717-A1 Use of PDE7 Inhibitors for the Treatment of Movement Disorders OMEROS CORPORATION (US) 2014-06-26 US disclosed
US-20130267502-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2013-10-10 US disclosed
US-20120115849-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2012-05-10 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-20120115849-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A PDE3B 9/4885PDE3A 4/4885PDE2A 6/4885
US-20160158247-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A PDE3B 9/4885PDE3A 4/4885PDE2A 6/4885
US-20160015715-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS PARK7, PDE7B, PDE7A PDE3B 15/4885PDE3A 7/4885PDE2A 11/4885
US-20140179717-A1 Use of PDE7 Inhibitors for the Treatment of Movement Disorders PARK7, PDE7B, PDE7A PDE3B 15/4885PDE3A 7/4885PDE2A 11/4885
US-20130267502-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A PDE3B 9/4885PDE3A 4/4885PDE2A 6/4885

“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.