SCHEMBL21062014

SCHEMBL21062014

Clc1cc(Cl)c2c(n1)CCS2

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL30712008 1.00 SMN1; SMN2 (0.38) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL26601795 0.89 TNKS (0.34) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL20416988 0.64 SMN1; SMN2 (0.36) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL30225174 0.63 ACHE (0.45) ALDH1A1L3MBTL1MEN1POLBKMT2A
SCHEMBL2624108 0.63 ACHE (0.49) MAPTMEN1KMT2AMAPK1
SCHEMBL3467970 0.63 ACHE (0.45) ALDH1A1L3MBTL1MEN1POLBKMT2A
Hydrochloric Acid SCHEMBL16668879 0.61 ACHE (0.47) MEN1KMT2AMAPK1
Hydrochloric Acid SCHEMBL29710413 0.61 ACHE (0.47) MEN1KMT2AMAPK1
SCHEMBL16987421 0.61 ACHE (0.47) MAPT
SCHEMBL3951992 0.58 SRC (0.38) SMN1; SMN2MAPTALDH1A1L3MBTL1MEN1

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-20240400578-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2024-12-05 US disclosed
US-11981681-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors UNION therapeutics A/S (DK) 2024-05-14 US disclosed
CN-111727191-B Substituted azetidine dihydro-thienopyridines and their use as phosphodiesterase inhibitors 联合疗法公司 2024-01-05 CN disclosed
US-20230087354-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2023-03-23 US disclosed
EP-3724196-B9 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2023-03-22 EP disclosed
EP-3724196-B1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2022-11-16 EP disclosed
EP-3724196-B1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2022-11-16 EP disclosed
US-11384096-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors UNION therapeutics A/S (DK) 2022-07-12 US disclosed
US-11384096-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors UNION therapeutics A/S (DK) 2022-07-12 US disclosed
US-20210079012-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2021-03-18 US disclosed
US-20210079012-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2021-03-18 US disclosed
EP-3724196-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2020-10-21 EP disclosed
CN-111727191-A Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors 利奥制药有限公司 2020-09-29 CN disclosed
WO-2019115776-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2019-06-20 WO disclosed
WO-2019115776-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2019-06-20 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-11384096-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors PDE2A, PDE3A, PDE3B SMN1; SMN2 1581/4885NPC1 1895/4885RAB9A 509/4885
US-11981681-B2 Substituted azetidine dihydrothienopyridines and their use as phosphodiesterase inhibitors PDE2A, PDE3A, PDE3B SMN1; SMN2 1581/4885NPC1 1895/4885RAB9A 509/4885
US-20240400578-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE2A, PDE3A, PDE3B SMN1; SMN2 1581/4885NPC1 1895/4885RAB9A 509/4885
US-20210079012-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE2A, PDE3A, PDE3B SMN1; SMN2 1581/4885NPC1 1895/4885RAB9A 509/4885
US-20230087354-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE2A, PDE3A, PDE3B SMN1; SMN2 1581/4885NPC1 1895/4885RAB9A 509/4885

“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.