SCHEMBL20051799

SCHEMBL20051799

COc1ccc(CNc2cc(Cl)cnn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
CNR1 P21554 1/20 0.51
CNR2 P34972 1/20 0.51
CLK4 Q9HAZ1 5/20 0.50
VNN1 O95497 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 2/20 0.46
DYRK1A Q13627 2/20 0.45
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
CLK1 P49759 1/20 0.45
CLK2 P49760 1/20 0.45
DYRK1B Q9Y463 1/20 0.45
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PDE5A O76074 1/20 0.44
HRH4 Q9H3N8 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL23221311 0.84 NPC1 (0.52) MAPTNPC1RAB9ACNR1CNR2
SCHEMBL30672320 0.81 APLNR (0.52) MAPTNPC1RAB9ACLK4KMT2A
SCHEMBL26663295 0.81 APLNR (0.52) MAPTNPC1RAB9ACLK4KMT2A
SCHEMBL21805769 0.77 NPC1 (0.61) MAPTNPC1RAB9ACLK4VNN1
SCHEMBL16290847 0.75 NPC1 (0.58) MAPTNPC1RAB9ACLK4KMT2A
SCHEMBL29889719 0.75 NPC1 (0.58) MAPTNPC1RAB9ACLK4KMT2A
SCHEMBL24460958 0.75 CLK4 (0.53) MAPTNPC1RAB9ACLK4HTT
SCHEMBL17376450 0.74 CNR1 (0.46) MAPTNPC1RAB9ACNR1CNR2
SCHEMBL14330643 0.74 CLK4 (0.56) MAPTNPC1RAB9ACLK4VNN1
SCHEMBL847193 0.74 ADRB1 (0.50) MAPTNPC1RAB9AHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11370784-B2 Cyano-substituted heterocycles with activity as inhibitors of USP30 MISSION THERAPEUTICS LIMITED (GB) 2022-06-28 US disclosed
CN-109803963-B Cyano-substituted heterocycles having USP30 inhibitor activity 特殊治疗有限公司 2022-04-26 CN disclosed
US-20210284631-A1 CYANO-SUBSTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LIMITED (GB) 2021-09-16 US disclosed
EP-3523291-B1 CYANO-SUBSTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LTD (GB) 2021-04-14 EP disclosed
WO-2018065768-A1 CYANO-SUBSTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 MISSION THERAPEUTICS LIMITED (GB) 2018-04-12 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 (2 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-20210284631-A1 CYANO-SUBSTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30 USP30, USP28, USP1 MAPT 3724/4885NPC1 3116/4885RAB9A 3037/4885
US-11370784-B2 Cyano-substituted heterocycles with activity as inhibitors of USP30 USP30, USP28, USP1 MAPT 3724/4885NPC1 3116/4885RAB9A 3037/4885

“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.