SCHEMBL19206497

SCHEMBL19206497

C=CCn1c2c(nc(NN)c1=O)CCCC2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
HIF1A Q16665 1/20 0.41
CYP3A4 P08684 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
NPSR1 Q6W5P4 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2B P29275 1/20 0.30

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
SCHEMBL19229539 0.78 ALDH1A1 (0.41) ALDH1A1GAAHIF1ACYP3A4L3MBTL1
SCHEMBL23373277 0.77 PDE4D (0.40)
SCHEMBL19206381 0.74 ALDH1A1 (0.33) ALDH1A1GAAHIF1A
SCHEMBL19212570 0.74 ALDH1A1 (0.33) ALDH1A1GAAHIF1A
SCHEMBL11498235 0.71 ALDH1A1 (0.36) ALDH1A1GAAHIF1ACYP3A4
SCHEMBL30395764 0.70 ALDH1A1 (0.32) ALDH1A1GAAHIF1A
SCHEMBL10376252 0.63 ALDH1A1 (0.31) ALDH1A1GAAHIF1AHTT
SCHEMBL19206540 0.63 ALDH1A1 (0.42) ALDH1A1GAAHIF1ACYP3A4RXFP1
SCHEMBL2719970 0.62 KDM4E (0.64) ALDH1A1GAACYP3A4NPSR1RXFP1
SCHEMBL11725290 0.59 CYP3A4 (0.41) ALDH1A1GAACYP3A4L3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914273-B [1,2,4] triazolo derivatives as PDE1 inhibitors for the treatment of diabetes 伊莱利利公司 2023-05-16 CN disclosed
US-11401274-B2 [1,2,4]Triazolo derivatives as PDE1 inhibitors for the treatment of diabetes ELI LILLY AND COMPANY (US) 2022-08-02 US disclosed
EP-3665174-B1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES LILLY CO ELI (US) 2021-09-15 EP disclosed
EP-3665174-B1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES LILLY CO ELI (US) 2021-09-15 EP disclosed
EP-3414249-B1 PDE1 INHIBITOR LILLY CO ELI (US) 2021-06-23 EP disclosed
EP-3414249-B1 PDE1 INHIBITOR LILLY CO ELI (US) 2021-06-23 EP disclosed
US-20210147437-A1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES ELI LILLY AND COMPANY 2021-05-20 US disclosed
US-20210147437-A1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES ELI LILLY AND COMPANY 2021-05-20 US disclosed
EP-3665174-A1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES Eli Lilly and Company (US) 2020-06-17 EP disclosed
CN-110914273-A [1,2,4] triazolo derivatives as PDE1 inhibitors for the treatment of diabetes 伊莱利利公司 2020-03-24 CN disclosed
WO-2019032383-A1 [1,2,4] TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES ELI LILLY AND COMPANY (US) 2019-02-14 WO disclosed
WO-2019032383-A1 [1,2,4] TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES ELI LILLY AND COMPANY (US) 2019-02-14 WO disclosed
US-10112951-B2 PDE1 inhibitor ELI LILLY AND COMPANY (US) 2018-10-30 US disclosed
US-20180099973-A1 PDE1 INHIBITOR ELI LILLY AND COMPANY (US) 2018-04-12 US disclosed
US-20180099973-A1 PDE1 INHIBITOR ELI LILLY AND COMPANY (US) 2018-04-12 US disclosed
US-9868741-B2 PDE1 inhibitor ELI LILLY AND COMPANY (US) 2018-01-16 US disclosed
US-9868741-B2 PDE1 inhibitor ELI LILLY AND COMPANY (US) 2018-01-16 US disclosed
WO-2017139186-A1 PDE1 INHIBITOR ELI LILLY AND COMPANY (US) 2017-08-17 WO disclosed
US-20170233396-A1 PDE1 INHIBITOR LILLY CO ELI (US) 2017-08-17 US disclosed
US-20170233396-A1 PDE1 INHIBITOR LILLY CO ELI (US) 2017-08-17 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-10112951-B2 PDE1 inhibitor PDE3B, PDE5A, PDE3A ALDH1A1 101/4885GAA 352/4885HIF1A 273/4885
US-20210147437-A1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES PDE3B, PDE3A, PDE5A ALDH1A1 1586/4885GAA 1490/4885HIF1A 1783/4885
US-11401274-B2 [1,2,4]Triazolo derivatives as PDE1 inhibitors for the treatment of diabetes PDE3B, PDE3A, PDE5A ALDH1A1 1586/4885GAA 1490/4885HIF1A 1783/4885
US-20180099973-A1 PDE1 INHIBITOR PDE3B, PDE5A, PDE3A ALDH1A1 101/4885GAA 352/4885HIF1A 273/4885
US-20170233396-A1 PDE1 INHIBITOR PDE3B, PDE5A, PDE3A ALDH1A1 101/4885GAA 352/4885HIF1A 273/4885

“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.