SCHEMBL20337692

SCHEMBL20337692

CCc1ncncc1C(=O)Nc1ccc(F)c(F)c1NC1CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.38
PDE10A Q9Y233 8/20 0.37
IRAK4 Q9NWZ3 1/20 0.35
LMNA P02545 2/20 0.35
KCNQ3 O43525 1/20 0.35
KCNQ2 O43526 1/20 0.35
MCHR1 Q99705 1/20 0.35
PDE4B Q07343 1/20 0.35
TYRO3 Q06418 2/20 0.34
MERTK Q12866 2/20 0.34
S1PR5 Q9H228 1/20 0.34
FLT3 P36888 1/20 0.34
GAS6 Q14393 1/20 0.34
AXL P30530 1/20 0.33
RPS6KB1 P23443 1/20 0.33

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
SCHEMBL20337737 0.84 IRAK4 (0.42) PDE10AIRAK4KCNQ3KCNQ2MCHR1
SCHEMBL20337658 0.82 MRGPRX1 (0.41) PDE10AIRAK4LMNATYRO3MERTK
SCHEMBL20339293 0.82 LCK (0.42) PDE10AIRAK4LMNATYRO3MERTK
SCHEMBL20337714 0.80 LMNA (0.46) IRAK4LMNA
SCHEMBL20337768 0.76 IRAK4 (0.44) PDE10AIRAK4
SCHEMBL20337738 0.75 ALDH1A1 (0.42) PDE10AIRAK4TYRO3MERTKFLT3
SCHEMBL20337696 0.71 MRGPRX1 (0.40) LMNA
SCHEMBL20337682 0.70 CRACR2A (0.47) PDE10AIRAK4KCNQ3KCNQ2
SCHEMBL20337710 0.70 IRAK4 (0.41) PDE10AIRAK4KCNQ3KCNQ2
SCHEMBL20337697 0.69 MAPK14 (0.44) PDE10AIRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3562306-B1 METALLOENZYME INHIBITOR COMPOUNDS JI XING PHARMACEUTICALS HONG KONG LTD (HK) 2025-02-26 EP disclosed
US-11919883-B2 Metalloenzyme inhibitor compounds JI XING PHARMACEUTICALS HONG KONG LIMITED (HK) 2024-03-05 US disclosed
US-20220009907-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2022-01-13 US disclosed
US-20220009907-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2022-01-13 US disclosed
US-11136309-B2 Metalloenzyme inhibitor compounds PHASEBIO PHARMACEUTICALS, INC. (US) 2021-10-05 US disclosed
US-11136309-B2 Metalloenzyme inhibitor compounds PHASEBIO PHARMACEUTICALS, INC. (US) 2021-10-05 US disclosed
US-20200392112-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2020-12-17 US disclosed
US-20200392112-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2020-12-17 US disclosed
EP-3562306-A2 METALLOENZYME INHIBITOR COMPOUNDS Selenity Therapeutics (Bermuda), Ltd. (BM) 2019-11-06 EP disclosed
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2018-07-05 US disclosed
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2018-07-05 US disclosed
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS CORXEL PHARMACEUTICALS HONG KONG LIMITED (HK) 2018-07-05 US disclosed
WO-2018125799-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS (BERMUDA), LTD. (BM) 2018-07-05 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-20200392112-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH S1PR1 4597/4885PDE10A 4261/4885IRAK4 4090/4885
US-20220009907-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH S1PR1 4597/4885PDE10A 4261/4885IRAK4 4090/4885
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH S1PR1 4597/4885PDE10A 4261/4885IRAK4 4090/4885
US-11136309-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH S1PR1 4597/4885PDE10A 4261/4885IRAK4 4090/4885
US-11919883-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH S1PR1 4597/4885PDE10A 4261/4885IRAK4 4090/4885

“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.