SCHEMBL8676339

SCHEMBL8676339

c1ccc(-c2ccc3c(c2)CNC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 1/20 0.50
NTRK2 Q16620 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
DYRK1B Q9Y463 1/20 0.50
TDP2 O95551 1/20 0.49
ASIC3 Q9UHC3 4/20 0.46
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
PARP10 Q53GL7 1/20 0.43
PARP11 Q9NR21 1/20 0.43
ALOX5 P09917 1/20 0.40
PNMT P11086 1/20 0.40
CD44 P16070 1/20 0.40
MAOB P27338 1/20 0.40
CD274 Q9NZQ7 1/20 0.40

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
SCHEMBL29543554 1.00 TYRO3 (0.50) TYRO3NTRK2CLK4DYRK1BTDP2
1,2,3,4-Tetrahydroisoquinoline SCHEMBL4892220 0.85 PNMT (0.66) ASIC3PNMTCD44MAOBCD274
SCHEMBL6347388 0.84 ASIC3 (0.65) ASIC3PARP10PARP11PNMTCD44
SCHEMBL30593253 0.84 PNMT (0.59) ASIC3PARP10PARP11PNMTCD44
SCHEMBL4663734 0.84 PNMT (0.59) ASIC3PARP10PARP11PNMTCD44
SCHEMBL29543449 0.81 ASIC3 (0.50) TDP2ASIC3PNMTALDH1A1
SCHEMBL29543416 0.81 ASIC3 (0.56) NTRK2TDP2ASIC3ALOX5PNMT
SCHEMBL22638762 0.81 CYP2D6 (0.49) TDP2ASIC3HTR1AHTR7
SCHEMBL29386484 0.81 CYP2D6 (0.49) TDP2ASIC3HTR1AHTR7
SCHEMBL30948932 0.79 PDE3B (0.50) ASIC3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515600-A Isoindoline compound and medical application thereof 中国科学院上海药物研究所 2024-08-20 CN disclosed
US-11319287-B2 Cyanopyrrolidines as dub inhibitors for the treatment of cancer MISSION THERAPEUTICS LIMITED (GB) 2022-05-03 US disclosed
EP-3800186-A1 CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER Mission Therapeutics Limited (GB) 2021-04-07 EP disclosed
US-20200231542-A1 CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER MISSION THERAPEUTICS LIMITED (GB) 2020-07-23 US disclosed
US-10669234-B2 Cyanopyrrolidines as dub inhibitors for the treatment of cancer MISSION THERAPEUTICS LIMITED (GB) 2020-06-02 US disclosed
US-10662159-B2 ABHD6 and dual ABHD6/MGL inhibitors and their uses MAKSCIENTIFIC, LLC (US) 2020-05-26 US disclosed
EP-3322702-B1 CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER MISSION THERAPEUTICS LTD (GB) 2019-11-20 EP disclosed
US-20190152917-A1 ABHD6 AND DUAL ABHD6/MGL INHIBITORS AND THEIR USES MAKSCIENTIFIC, LLC 2019-05-23 US disclosed
US-20180194724-A1 CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER MISSION THERAPEUTICS LIMITED (GB) 2018-07-12 US disclosed
US-5726197-A ADRENORECEPTORS AND ADMINISTERING SYNTEX (U.S.A.) INC. (US) 1998-03-10 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 (6 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-10662159-B2 ABHD6 and dual ABHD6/MGL inhibitors and their uses ABHD6, FAAH, FAAH2 TYRO3 4534/4885NTRK2 2814/4885CLK4 1352/4885
US-10669234-B2 Cyanopyrrolidines as dub inhibitors for the treatment of cancer USP30, USP39, UCHL1 TYRO3 3944/4885NTRK2 4458/4885CLK4 2115/4885
US-20180194724-A1 CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER USP30, USP39, UCHL1 TYRO3 3944/4885NTRK2 4458/4885CLK4 2115/4885
US-20190152917-A1 ABHD6 AND DUAL ABHD6/MGL INHIBITORS AND THEIR USES ABHD6, FAAH, FAAH2 TYRO3 4534/4885NTRK2 2814/4885CLK4 1352/4885
US-20200231542-A1 CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER USP30, USP39, UCHL1 TYRO3 3944/4885NTRK2 4458/4885CLK4 2115/4885
US-11319287-B2 Cyanopyrrolidines as dub inhibitors for the treatment of cancer USP30, USP39, UCHL1 TYRO3 3944/4885NTRK2 4458/4885CLK4 2115/4885

“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.