SCHEMBL299960

SCHEMBL299960

Cc1nc(Nc2nc(NCC3CCCO3)cc(N3CCN(C)CC3)n2)sc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PDE5A O76074 5/20 0.46
TNK2 Q07912 6/20 0.41
ALOX12 P18054 1/20 0.40
SRC P12931 3/20 0.40
JAK2 O60674 2/20 0.40
ALK Q9UM73 2/20 0.40
LCK P06239 2/20 0.40
CHEK1 O14757 1/20 0.40
ABL1 P00519 1/20 0.40
ROS1 P08922 1/20 0.40
FGFR1 P11362 1/20 0.40
TYK2 P29597 1/20 0.40
AURKA O14965 2/20 0.39
IGF1R P08069 1/20 0.38
HCAR3 P49019 1/20 0.38
RIPK1 Q13546 1/20 0.37

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
SCHEMBL26647595 0.93 HTT (0.48) HPGDMAPK1HTTHSD17B10PDE5A
SCHEMBL28575919 0.91 HPGD (0.62) HPGDMAPK1HTTHSD17B10PDE5A
SCHEMBL29408494 0.91 HPGD (0.62) HPGDMAPK1HTTHSD17B10PDE5A
SCHEMBL289834 0.83 HPGD (0.63) HPGDMAPK1HTTHSD17B10PDE5A
SCHEMBL291741 0.81 PDE5A (0.61) HPGDMAPK1HTTHSD17B10PDE5A
SCHEMBL26647638 0.80 PDE5A (0.57) HPGDPDE5AABL1AURKA
SCHEMBL291205 0.78 PDE5A (0.56) PDE5AAURKA
SCHEMBL27950966 0.78 PDE5A (0.69) HPGDPDE5AFGFR1AURKARIPK1
SCHEMBL27950945 0.77 PDE5A (0.57) HPGDPDE5AAURKARIPK1AURKB
SCHEMBL2680007 0.76 HRH4 (0.57) PDE5AAURKA

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087614-B2 Pyrimidine inhibitors of phosphodiesterase (PDE) 7 BRISTOL-MYERS SQUIBB CO. (US) 2006-08-08 US claimed
EP-4275752-A2 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS Omeros Corporation (US) 2023-11-15 EP disclosed
US-20230110784-A1 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS OMEROS CORPORATION 2023-04-13 US disclosed
CN-115192711-A Use of PDE7 inhibitors for the treatment of movement disorders 奥默罗斯公司 2022-10-18 CN disclosed
US-11207275-B2 Treatment of addiction and impulse-control disorders using PDE7 inhibitors OMEROS CORPORATION (US) 2021-12-28 US disclosed
US-20190134055-A1 Treatment of Addiction and Impulse-control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2019-05-09 US disclosed
EP-2846805-B1 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS OMEROS CORP (US) 2018-11-21 EP disclosed
US-20180289632-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2018-10-11 US disclosed
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-8637528-B2 Use of PDE7 inhibitors for the treatment of movement disorders OMEROS CORPORATION (US) 2014-01-28 US disclosed
WO-2013176877-A2 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS OMEROS CORPORATION (US) 2013-11-28 WO disclosed
US-20130267502-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2013-10-10 US disclosed
EP-2640395-A2 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS Omeros Corporation (US) 2013-09-25 EP disclosed
WO-2012064667-A2 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS OMEROS CORPORATION (US) 2012-05-18 WO disclosed
US-20120115849-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors OMEROS CORPORATION 2012-05-10 US disclosed
EP-2427193-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS Omeros Corporation (US) 2012-03-14 EP disclosed
WO-2010129036-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS OMEROS CORPORATION (US) 2010-11-11 WO disclosed
US-20100113486-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS OMEROS CORPORATION (US) 2010-05-06 US disclosed
US-7087614-B2 Pyrimidine inhibitors of phosphodiesterase (PDE) 7 BRISTOL-MYERS SQUIBB CO. (US) 2006-08-08 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 (9 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-20180289632-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-20120115849-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-20160158247-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-11207275-B2 Treatment of addiction and impulse-control disorders using PDE7 inhibitors PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-20230110784-A1 TREATMENT OF ADDICTION AND IMPULSE-CONTROL DISORDERS USING PDE7 INHIBITORS PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-20160015715-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS PARK7, PDE7B, PDE7A HPGD 2485/4885MAPK1 2183/4885HTT 784/4885
US-20130267502-A1 Treatment of Addiction and Impulse-Control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-20190134055-A1 Treatment of Addiction and Impulse-control Disorders Using PDE7 Inhibitors PDE7B, PDE4C, PDE4A HPGD 2880/4885MAPK1 2208/4885HTT 3055/4885
US-20100113486-A1 USE OF PDE7 INHIBITORS FOR THE TREATMENT OF MOVEMENT DISORDERS PARK7, PDE7B, PDE7A HPGD 2485/4885MAPK1 2183/4885HTT 784/4885

“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.