SCHEMBL22993457

SCHEMBL22993457

CC(C)Cc1nn(C)c2c1CCN(C)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NMT1 P30419 5/20 0.38
PDE2A O00408 1/20 0.33
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
GRIA2 P42262 1/20 0.31
ALDH1A1 P00352 3/20 0.30
HPGD P15428 3/20 0.30
KDM4E B2RXH2 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
GAA P10253 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
CASP1 P29466 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL24253505 0.87 NMT1 (0.38) NMT1PDE2ACYP2C19
SCHEMBL17234815 0.81 GAA (0.34) GRIA2ALDH1A1HPGDKDM4EGAA
SCHEMBL16123851 0.75 CYP2C19 (0.36) GRIA2ALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL17232685 0.72 CYP2C19 (0.35) GRIA2ALDH1A1HPGDKDM4EGAA
SCHEMBL22993455 0.71 CYP2C19 (0.32) NMT1ALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL26373425 0.70 CYP2C19 (0.34) GRIA2ALDH1A1HPGDKDM4EGAA
SCHEMBL21196044 0.70 CYP2C19 (0.34) GRIA2ALDH1A1HPGDKDM4EGAA
SCHEMBL26373420 0.70 CYP2C19 (0.34) GRIA2ALDH1A1HPGDKDM4EGAA
SCHEMBL17234811 0.68 PDE10A (0.38) CYP2C19
SCHEMBL24253310 0.68 CYP2C19 (0.38) NMT1ALDH1A1HPGDSMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250080-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2023-08-10 US disclosed
US-20230250080-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LTD (GB) 2023-08-10 US disclosed
US-11613527-B2 Enzyme inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2023-03-28 US disclosed
US-20220048894-A1 ENZYME INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-02-17 US disclosed
WO-2021028649-A1 PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-02-18 WO disclosed
WO-2021028645-A1 PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-02-18 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 (3 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-20230250080-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 NMT1 1774/4885PDE2A 629/4885HSP90AA1 3893/4885
US-11613527-B2 Enzyme inhibitors SERPINB1, KLKB1, SERPINE1 NMT1 1774/4885PDE2A 629/4885HSP90AA1 3893/4885
US-20220048894-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 NMT1 1774/4885PDE2A 629/4885HSP90AA1 3893/4885

“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.