SCHEMBL20870262

SCHEMBL20870262

N#Cc1c(O)c2ccncc2[nH]c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 9/20 1.00
▸ KDM5B Q9UGL1 2/20 1.00
▸ KDM5C P41229 1/20 1.00
▸ PDE9A O76083 7/20 0.56
▸ PARP1 P09874 1/20 0.50
▸ FGFR1 P11362 1/20 0.49
▸ FLT1 P17948 1/20 0.49
▸ CHUK O15111 1/20 0.46
▸ GRIN2D O15399 1/20 0.45
▸ GRIN3B O60391 1/20 0.45
▸ GRIN1 Q05586 1/20 0.45
▸ GRIN2A Q12879 1/20 0.45
▸ GRIN2B Q13224 1/20 0.45
▸ GRIN2C Q14957 1/20 0.45
▸ GRIN3A Q8TCU5 1/20 0.45

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
SCHEMBL22871658 0.86 KDM5A (0.75) KDM5AKDM5BKDM5CPDE9APARP1
SCHEMBL22298103 0.82 KDM5A (0.69) KDM5AKDM5BKDM5CPDE9APARP1
SCHEMBL4754631 0.82 KDM5A (0.69) KDM5AKDM5BKDM5CPDE9APARP1
SCHEMBL14442482 0.78 KDM5A (0.64) KDM5AKDM5BKDM5CPDE9APARP1
SCHEMBL13913155 0.78 KDM5A (0.63) KDM5AKDM5BKDM5CPDE9AGRIN2D
SCHEMBL22298231 0.75 PDE9A (0.80) KDM5AKDM5BKDM5CPDE9A
SCHEMBL20870616 0.74 KDM5A (0.59) KDM5AKDM5BKDM5CPDE9APARP1
SCHEMBL20870101 0.74 PDE9A (0.79) KDM5AKDM5BKDM5CPDE9A
SCHEMBL20870243 0.74 PDE9A (0.79) KDM5AKDM5BKDM5CPDE9A
SCHEMBL20870083 0.74 KDM5A (0.58) KDM5AKDM5BKDM5CPDE9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190873-A1 METHOD FOR PREPARING PHOSPHODIESTERASE INHIBITOR TRANSTHERA SCIENCES (NANJING), INC. (CN) 2024-06-13 — — US disclosed
EP-4317159-A1 METHOD FOR PREPARING PHOSPHODIESTERASE INHIBITOR Transthera Sciences (Nanjing), Inc. (CN) 2024-02-07 — — EP disclosed
CN-115197211-A Process for preparing phosphodiesterase inhibitor 药捷安康(南京)科技股份有限公司 2022-10-18 — — CN disclosed
US-11434248-B2 PDE9 inhibitor and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2022-09-06 — — US disclosed
CN-113956252-A PDE9 inhibitors and uses thereof 药捷安康(南京)科技股份有限公司 2022-01-21 — — CN disclosed
CN-109575016-B PDE9 inhibitors and uses thereof 药捷安康(南京)科技股份有限公司 2022-01-04 — — CN disclosed
US-20210130366-A1 PDE9 INHIBITOR AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2021-05-06 — — US disclosed
US-20210130366-A1 PDE9 INHIBITOR AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2021-05-06 — — US disclosed
US-10889591-B2 PDE9 inhibitor and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2021-01-12 — — US disclosed
US-10889591-B2 PDE9 inhibitor and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2021-01-12 — — US disclosed
EP-3689876-A1 PDE9 INHIBITOR AND USE THEREOF Nanjing Transthera Biosciences Co. Ltd. (CN) 2020-08-05 — — EP disclosed
EP-3689876-A1 PDE9 INHIBITOR AND USE THEREOF Nanjing Transthera Biosciences Co. Ltd. (CN) 2020-08-05 — — EP disclosed
US-20200115384-A1 PDE9 INHIBITOR AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2020-04-16 — — US disclosed
CN-109575016-A PDE9 inhibitors and uses thereof 南京药捷安康生物科技有限公司 2019-04-05 — — CN disclosed
WO-2019062733-A1 PDE9 INHIBITOR AND USE THEREOF 南京药捷安康生物科技有限公司 2019-04-04 — — 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 (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-10889591-B2 PDE9 inhibitor and use thereof PDE3A, PDE9A, PDE3B KDM5A 1199/4885KDM5B 1464/4885KDM5C 2394/4885
US-20210130366-A1 PDE9 INHIBITOR AND USE THEREOF PDE3A, PDE9A, PDE3B KDM5A 1199/4885KDM5B 1464/4885KDM5C 2394/4885
US-11434248-B2 PDE9 inhibitor and use thereof PDE3A, PDE9A, PDE3B KDM5A 1199/4885KDM5B 1464/4885KDM5C 2394/4885
US-20200115384-A1 PDE9 INHIBITOR AND USE THEREOF PDE3A, PDE9A, PDE3B KDM5A 1199/4885KDM5B 1464/4885KDM5C 2394/4885
US-20240190873-A1 METHOD FOR PREPARING PHOSPHODIESTERASE INHIBITOR PDE5A, PDE3A, PDE3B KDM5A 898/4885KDM5B 1151/4885KDM5C 1261/4885

“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.

Send feedback