SCHEMBL16748877

SCHEMBL16748877

Clc1nccn2c(C3CC3)ncc12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE1C Q14123 14/20 0.44
PDE1B Q01064 11/20 0.43
PDE1A P54750 10/20 0.43
TNK2 Q07912 1/20 0.33
KCNH2 Q12809 1/20 0.33
FGFR1 P11362 1/20 0.31

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
SCHEMBL400651 0.95 PDE1C (0.43) PDE1CPDE1BPDE1ATNK2KCNH2
SCHEMBL18099738 0.93 PDE1C (0.46) PDE1CPDE1BPDE1ATNK2FGFR1
SCHEMBL4313118 0.92 PDE1C (0.40) PDE1CPDE1BPDE1ATNK2
SCHEMBL13962521 0.92 PDE1C (0.47) PDE1CPDE1BPDE1ATNK2
SCHEMBL2327173 0.89 PDE1C (0.50) PDE1CPDE1BPDE1A
SCHEMBL13962531 0.89 PDE1C (0.37) PDE1CPDE1BPDE1ATNK2
SCHEMBL397982 0.89 PDE1C (0.43) PDE1CPDE1BPDE1ATNK2
SCHEMBL397983 0.89 PDE1C (0.43) PDE1CPDE1BPDE1ATNK2
SCHEMBL23217412 0.88 PDE1C (0.42) PDE1CPDE1BPDE1A
SCHEMBL2321250 0.88 PDE1C (0.36) PDE1CPDE1BPDE1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025067411-A1 NEK7 INHIBITOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF 北京普祺医药科技股份有限公司 2025-04-03 WO disclosed
US-12162890-B2 Heteroaromatic NMDA receptor modulators and uses thereof NOVARTIS AG (CH) 2024-12-10 US disclosed
US-20230023543-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2023-01-26 US disclosed
US-20230023543-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2023-01-26 US disclosed
US-11472810-B2 Imidazopyrazinones as PDE1 inhibitors H. LUNDBECK A/S (DK) 2022-10-18 US disclosed
US-11236104-B2 Heteroaromatic NMDA receptor modulators and uses thereof CADENT THERAPEUTICS, INC. (US) 2022-02-01 US disclosed
US-11236104-B2 Heteroaromatic NMDA receptor modulators and uses thereof CADENT THERAPEUTICS, INC. (US) 2022-02-01 US disclosed
US-20210238182-A1 IMIDAZOPYRAZINONES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2021-08-05 US disclosed
US-20210238182-A1 IMIDAZOPYRAZINONES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2021-08-05 US disclosed
US-20210107916-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2021-04-15 US disclosed
WO-2017100591-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF LUC THERAPEUTICS (US) 2017-06-15 WO disclosed
WO-2017100591-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF LUC THERAPEUTICS (US) 2017-06-15 WO disclosed
US-20160318939-A1 Imidazopyrazinones as PDE1 Inhibitors H. LUNDBECK A/S (DK) 2016-11-03 US disclosed
US-20160318939-A1 Imidazopyrazinones as PDE1 Inhibitors H. LUNDBECK A/S (DK) 2016-11-03 US disclosed
US-20160318939-A1 Imidazopyrazinones as PDE1 Inhibitors H. LUNDBECK A/S (DK) 2016-11-03 US disclosed
WO-2016174188-A1 IMIDAZOPYRAZINONES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2016-11-03 WO disclosed
WO-2016174188-A1 IMIDAZOPYRAZINONES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2016-11-03 WO disclosed
US-20160280711-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2016-09-29 US disclosed
US-20160280711-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2016-09-29 US disclosed
WO-2015074138-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE INC. (CA) 2015-05-28 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 (8 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-20160318939-A1 Imidazopyrazinones as PDE1 Inhibitors PDE12, PDE4A, PDE5A PDE1C 15/4885PDE1B 10/4885PDE1A 7/4885
US-20160280711-A1 Protein Kinase Inhibitors TEC, LCK, SRC PDE1C 1830/4885PDE1B 1977/4885PDE1A 1718/4885
US-11236104-B2 Heteroaromatic NMDA receptor modulators and uses thereof GRIN2C, GRIN2A, GRIN1 PDE1C 1752/4885PDE1B 1688/4885PDE1A 1357/4885
US-12162890-B2 Heteroaromatic NMDA receptor modulators and uses thereof GRIN2C, GRIN2A, GRIN1 PDE1C 1752/4885PDE1B 1688/4885PDE1A 1357/4885
US-20210238182-A1 IMIDAZOPYRAZINONES AS PDE1 INHIBITORS PDE12, PDE4A, PDE5A PDE1C 15/4885PDE1B 10/4885PDE1A 7/4885
US-11472810-B2 Imidazopyrazinones as PDE1 inhibitors PDE12, PDE4A, PDE5A PDE1C 15/4885PDE1B 10/4885PDE1A 7/4885
US-20230023543-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN2C, GRIN2A, GRIN1 PDE1C 1752/4885PDE1B 1688/4885PDE1A 1357/4885
US-20210107916-A1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN2C, GRIN2A, GRIN1 PDE1C 1752/4885PDE1B 1688/4885PDE1A 1357/4885

“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.