SCHEMBL20337776

SCHEMBL20337776

CCNc1cc(C#N)ccc1NC(=O)c1cncnc1C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.44
KMT2A Q03164 2/20 0.40
IRAK4 Q9NWZ3 3/20 0.40
VNN1 O95497 2/20 0.39
GPR6 P46095 1/20 0.39
MEN1 O00255 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PDE10A Q9Y233 2/20 0.38
ABL1 P00519 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
GRM5 P41594 1/20 0.37
F10 P00742 1/20 0.37
TMPRSS4 Q9NRS4 1/20 0.36
CRACR2A Q9BSW2 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL20337772 0.88 IRAK4 (0.44) MAPK14KMT2AIRAK4VNN1GPR6
SCHEMBL20337685 0.86 KMT2A (0.40) MAPK14KMT2AIRAK4VNN1GPR6
SCHEMBL20337759 0.85 IRAK4 (0.43) MAPK14KMT2AIRAK4VNN1GPR6
SCHEMBL20337784 0.85 IRAK4 (0.41) MAPK14KMT2AIRAK4VNN1GPR6
SCHEMBL20337785 0.83 IRAK4 (0.46) MAPK14KMT2AIRAK4GPR6PDE10A
SCHEMBL20345759 0.79 CRACR2A (0.42) IRAK4L3MBTL1PDE10AABL1CRACR2A
SCHEMBL20345761 0.76 ABL1 (0.41) KMT2AIRAK4MEN1PDE10AABL1
SCHEMBL26698349 0.75 KMT2A (0.46) MAPK14KMT2AVNN1MEN1L3MBTL1
SCHEMBL20337697 0.75 MAPK14 (0.44) MAPK14KMT2AIRAK4GPR6PDE10A
SCHEMBL20337768 0.74 IRAK4 (0.44) MAPK14KMT2AIRAK4GPR6MEN1

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 12 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
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 MAPK14 2945/4885KMT2A 2849/4885IRAK4 4090/4885
US-20220009907-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH MAPK14 2945/4885KMT2A 2849/4885IRAK4 4090/4885
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH MAPK14 2945/4885KMT2A 2849/4885IRAK4 4090/4885
US-11136309-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH MAPK14 2945/4885KMT2A 2849/4885IRAK4 4090/4885
US-11919883-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH MAPK14 2945/4885KMT2A 2849/4885IRAK4 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.