SCHEMBL19206550

SCHEMBL19206550

C=CCNC(=O)C(=O)NC1CCCCC1O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.38
ALDH1A1 P00352 4/20 0.37
NPSR1 Q6W5P4 2/20 0.37
RAB9A P51151 3/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
GAA P10253 1/20 0.33
NPC1 O15118 1/20 0.33
TDO2 P48775 1/20 0.33
CNR2 P34972 1/20 0.33
MEN1 O00255 1/20 0.32
CHRM1 P11229 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
SCHEMBL19206533 0.77 EPHX1 (0.42) POLBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL20723435 0.75 EPHX1 (0.45) POLBRAB9AKDM4ESMN1; SMN2MAPT
SCHEMBL6396632 0.73 ALDH1A1 (0.37) KMT2AALDH1A1
SCHEMBL6397294 0.73 ALDH1A1 (0.37) KMT2AALDH1A1
SCHEMBL6397302 0.73 ALDH1A1 (0.37) KMT2AALDH1A1
SCHEMBL4952777 0.72 TSHR (0.56) KMT2AALDH1A1RAB9AKDM4ESMN1; SMN2
SCHEMBL8332594 0.71 ALDH1A1 (0.43) KMT2AALDH1A1NPSR1RAB9AMAPT
SCHEMBL8332590 0.71 ALDH1A1 (0.43) KMT2AALDH1A1NPSR1RAB9AMAPT
SCHEMBL19206562 0.71 KMT2A (0.40) KMT2AALDH1A1NPSR1RAB9AKDM4E
SCHEMBL9578877 0.70 CNR2 (0.36) POLBALDH1A1NPSR1RAB9ASMN1; SMN2

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 19 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-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
EP-3414249-A1 PDE1 INHIBITOR Eli Lilly and Company (US) 2018-12-19 EP 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
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 KMT2A 1744/4885POLB 4189/4885ALDH1A1 101/4885
US-20210147437-A1 [1,2,4]TRIAZOLO DERIVATIVES AS PDE1 INHIBITORS FOR THE TREATMENT OF DIABETES PDE3B, PDE3A, PDE5A KMT2A 2806/4885POLB 1976/4885ALDH1A1 1586/4885
US-11401274-B2 [1,2,4]Triazolo derivatives as PDE1 inhibitors for the treatment of diabetes PDE3B, PDE3A, PDE5A KMT2A 2806/4885POLB 1976/4885ALDH1A1 1586/4885
US-20180099973-A1 PDE1 INHIBITOR PDE3B, PDE5A, PDE3A KMT2A 1744/4885POLB 4189/4885ALDH1A1 101/4885
US-20170233396-A1 PDE1 INHIBITOR PDE3B, PDE5A, PDE3A KMT2A 1744/4885POLB 4189/4885ALDH1A1 101/4885

“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.