SCHEMBL17142244

SCHEMBL17142244

COc1ccc2c(NC3CCOC3)ncnc2c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.47
▸ JAK1 P23458 2/20 0.47
▸ ADORA3 P0DMS8 4/20 0.43
▸ ADORA2A P29274 4/20 0.43
▸ ADORA2B P29275 4/20 0.43
▸ ADORA1 P30542 4/20 0.43
▸ IRAK4 Q9NWZ3 5/20 0.42
▸ CD38 P28907 1/20 0.42
▸ BRAF P15056 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ TTK P33981 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ PDE1A P54750 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
SCHEMBL16822558 0.87 PDE1B (0.51) JAK2JAK1ADORA3ADORA2AADORA2B
SCHEMBL16822559 0.87 PDE1B (0.51) JAK2JAK1ADORA3ADORA2AADORA2B
SCHEMBL16822617 0.87 PDE1B (0.51) JAK2JAK1ADORA3ADORA2AADORA2B
SCHEMBL17142294 0.86 JAK2 (0.47) JAK2JAK1ADORA3ADORA2AADORA2B
SCHEMBL17142254 0.79 PDE1B (0.37) JAK2JAK1IRAK4USP2LMNA
SCHEMBL17142296 0.74 ELOVL1 (0.44) JAK2JAK1BRAFLMNAPDE1A
SCHEMBL18394840 0.73 PDE1B (0.37) TSHRKCNH2PDE1APDE1BPDE1C
SCHEMBL17142270 0.73 PDE1B (0.37) TSHRKCNH2PDE1APDE1BPDE1C
SCHEMBL17142297 0.73 PDE1B (0.37) TSHRKCNH2PDE1APDE1BPDE1C
SCHEMBL17142268 0.70 PDE1B (0.48) PDE1APDE1BPDE1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3126354-B1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H LUNDBECK AS (DK) 2020-01-22 — — EP claimed
US-20190144434-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2019-05-16 — — US claimed
US-10005764-B2 Halogenated quinazolin-THF-amines as PDE1 inhibitors H. LUNDBECK A/S (DK) 2018-06-26 — — US claimed
US-20170022186-A1 Halogenated Quinazolin-THF-Amines as PDE1 Inhibitors H. LUNDBECK A/S (DK) 2017-01-26 — — US claimed
EP-3126354-B1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H LUNDBECK AS (DK) 2020-01-22 — — EP disclosed
EP-3126354-B1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H LUNDBECK AS (DK) 2020-01-22 — — EP disclosed
US-20190144434-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2019-05-16 — — US disclosed
US-20190144434-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2019-05-16 — — US disclosed
US-10005764-B2 Halogenated quinazolin-THF-amines as PDE1 inhibitors H. LUNDBECK A/S (DK) 2018-06-26 — — US disclosed
US-10005764-B2 Halogenated quinazolin-THF-amines as PDE1 inhibitors H. LUNDBECK A/S (DK) 2018-06-26 — — US disclosed
US-10005764-B2 Halogenated quinazolin-THF-amines as PDE1 inhibitors H. LUNDBECK A/S (DK) 2018-06-26 — — US disclosed
EP-3126354-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H. Lundbeck A/S (DK) 2017-02-08 — — EP disclosed
US-20170022186-A1 Halogenated Quinazolin-THF-Amines as PDE1 Inhibitors H. LUNDBECK A/S (DK) 2017-01-26 — — US disclosed
US-20170022186-A1 Halogenated Quinazolin-THF-Amines as PDE1 Inhibitors H. LUNDBECK A/S (DK) 2017-01-26 — — US disclosed
WO-2015150254-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2015-10-08 — — WO disclosed
WO-2015150254-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS H. LUNDBECK A/S (DK) 2015-10-08 — — 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 (3 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-20190144434-A1 HALOGENATED QUINAZOLIN-THF-AMINES AS PDE1 INHIBITORS PDE12, PDE3A, PDE7B JAK2 3020/4885JAK1 521/4885ADORA3 2180/4885
US-10005764-B2 Halogenated quinazolin-THF-amines as PDE1 inhibitors PDE12, PDE3A, PDE7B JAK2 3020/4885JAK1 521/4885ADORA3 2180/4885
US-20170022186-A1 Halogenated Quinazolin-THF-Amines as PDE1 Inhibitors PDE12, PDE3A, PDE7B JAK2 3020/4885JAK1 521/4885ADORA3 2180/4885

“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.

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