SCHEMBL22993267

SCHEMBL22993267

CC(C)Cc1ccc2c(n1)CCN(C)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.43
CYP2C9 P11712 1/20 0.42
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40
NMT1 P30419 2/20 0.36
HSP90AA1 P07900 1/20 0.35
KDM4E B2RXH2 7/20 0.35
MAPT P10636 7/20 0.35
ALDH1A1 P00352 5/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
USP2 O75604 2/20 0.34
ALOX15 P16050 2/20 0.34
HSD17B10 Q99714 2/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL24253486 0.88 MAOA (0.40) CYP2C19CYP2C9MAOAMAOBNMT1
SCHEMBL21730188 0.84 MAPT (0.36) MAPTKMT2AMEN1CDK4CDK2
SCHEMBL18563784 0.83 CYP2C19 (0.47) CYP2C19CYP2C9MAOAMAOBKDM4E
SCHEMBL22723932 0.78 CYP3A4 (0.37) MAPTALDH1A1HSD17B10TSHRPOLB
SCHEMBL22993375 0.77 CYP2C19 (0.44) CYP2C19CYP2C9MAOAMAOBNMT1
SCHEMBL20203638 0.76 CYP2C9 (0.44) CYP2C19CYP2C9MAOAMAOBHSP90AA1
SCHEMBL22387665 0.76 ADRA2A (0.37) KDM4ETSHR
SCHEMBL11639939 0.76 ADRA2A (0.40) ALDH1A1TSHRCDK2
SCHEMBL24221619 0.75 GRM5 (0.32)
SCHEMBL24221623 0.75 GRM5 (0.33) MAOAMAOBNMT1KDM4EALDH1A1

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-2021028645-A1 PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-02-18 WO disclosed
WO-2021028649-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 CYP2C19 944/4885CYP2C9 1178/4885MAOA 175/4885
US-11613527-B2 Enzyme inhibitors SERPINB1, KLKB1, SERPINE1 CYP2C19 944/4885CYP2C9 1178/4885MAOA 175/4885
US-20220048894-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 CYP2C19 944/4885CYP2C9 1178/4885MAOA 175/4885

“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.