SCHEMBL20337797

SCHEMBL20337797

COC(=O)c1ccc(NC(=O)c2cncnc2C(F)(F)F)c(NC2CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 1/20 0.38
WDR5 P61964 1/20 0.38
CRACR2A Q9BSW2 1/20 0.38
MAP3K7 O43318 1/20 0.38
LCK P06239 1/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
DYRK1A Q13627 2/20 0.36
DYRK1B Q9Y463 2/20 0.36
CREBBP Q92793 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCD Q05655 1/20 0.36
BTK Q06187 1/20 0.36
MAPT P10636 1/20 0.36
IRAK4 Q9NWZ3 2/20 0.35
YAP1 P46937 1/20 0.35

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
SCHEMBL20337778 0.82 PRKCQ (0.44) WDR5PRKCQPRKCDIRAK4
SCHEMBL20337733 0.81 WDR5 (0.44) WDR5CRACR2APRKCQPRKCDIRAK4
SCHEMBL20345765 0.76 CRACR2A (0.46) CRACR2AMAP3K7MAPK11MAPK14CREBBP
SCHEMBL20337645 0.75 XPO1 (0.39) WDR5IRAK4
SCHEMBL20337786 0.74 GPR6 (0.53)
SCHEMBL20337642 0.74 ATF1 (0.40) WDR5PRKCQPRKCDIRAK4
SCHEMBL20337787 0.72 CRACR2A (0.47) CRACR2A
SCHEMBL13531238 0.71 MAPT (0.46) ALDH1A1KDM4EMAPT
SCHEMBL20337718 0.70 GPR6 (0.49) PRKCQPRKCDIRAK4
SCHEMBL20337734 0.70 PDE10A (0.39) IRAK4

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
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 ALDH1A1 457/4885KDM4E 3875/4885HPGD 525/4885
US-20220009907-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH ALDH1A1 457/4885KDM4E 3875/4885HPGD 525/4885
US-20180186773-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH ALDH1A1 457/4885KDM4E 3875/4885HPGD 525/4885
US-11136309-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH ALDH1A1 457/4885KDM4E 3875/4885HPGD 525/4885
US-11919883-B2 Metalloenzyme inhibitor compounds SOD1, RNASE1, FECH ALDH1A1 457/4885KDM4E 3875/4885HPGD 525/4885

“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.