SCHEMBL20337658

SCHEMBL20337658

CCc1ncncc1C(=O)Nc1ccc(F)cc1NC1CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 7/20 0.41
TSPO P30536 2/20 0.41
HRH1 P35367 1/20 0.39
TSHR P16473 1/20 0.39
PDE10A Q9Y233 6/20 0.39
GPR6 P46095 2/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
LMNA P02545 1/20 0.38
AXL P30530 1/20 0.37
TYRO3 Q06418 1/20 0.37
MERTK Q12866 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL20337738 0.92 ALDH1A1 (0.42) MRGPRX1TSPOHRH1TSHRPDE10A
SCHEMBL20337737 0.89 IRAK4 (0.42) PDE10AIRAK4
SCHEMBL20337714 0.88 LMNA (0.46) MRGPRX1TSHRIRAK4LMNA
SCHEMBL20337787 0.86 CRACR2A (0.47) MRGPRX1TSPOHRH1PDE10AGPR6
SCHEMBL20337768 0.85 IRAK4 (0.44) PDE10AGPR6IRAK4
SCHEMBL20337696 0.85 MRGPRX1 (0.40) MRGPRX1TSPOTSHRLMNAALDH1A1
SCHEMBL20337734 0.83 PDE10A (0.39) MRGPRX1TSPOPDE10AGPR6IRAK4
SCHEMBL20337786 0.83 GPR6 (0.53) GPR6
SCHEMBL20337692 0.82 S1PR1 (0.38) PDE10AIRAK4LMNAAXLTYRO3
SCHEMBL20337715 0.82 GPR6 (0.39) MRGPRX1TSPOPDE10AGPR6IRAK4

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 14 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
WO-2018125799-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS (BERMUDA), LTD. (BM) 2018-07-05 WO disclosed
WO-2018125799-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS (BERMUDA), LTD. (BM) 2018-07-05 WO 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

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 MRGPRX1 1223/4885TSPO 931/4885HRH1 3152/4885
US-20220009907-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH MRGPRX1 1223/4885TSPO 931/4885HRH1 3152/4885
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH MRGPRX1 1223/4885TSPO 931/4885HRH1 3152/4885
US-11136309-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH MRGPRX1 1223/4885TSPO 931/4885HRH1 3152/4885
US-11919883-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH MRGPRX1 1223/4885TSPO 931/4885HRH1 3152/4885

“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.