SCHEMBL24253321

SCHEMBL24253321

CC(C)c1ccc2c(c1)CN(C)CC2(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
HPGD P15428 1/20 0.34
GFER P55789 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KARS1 Q15046 2/20 0.33
TSHR P16473 2/20 0.33
PDK2 Q15119 2/20 0.33
PDK1 Q15118 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL19406904 0.89 HPGD (0.35) NPSR1HPGDGFERHSD17B10ALDH1A1
SCHEMBL20891233 0.82 HPGD (0.38) NPSR1HPGDGFERHSD17B10ALDH1A1
SCHEMBL24253344 0.81 KDM4E (0.44) NPSR1HPGDGFERHSD17B10ALDH1A1
SCHEMBL22993438 0.80 SLC6A2 (0.40) ALDH1A1CYP2D6KDM4EMAPT
SCHEMBL26956228 0.79 BRD4 (0.41) MEN1KMT2AKDM4E
SCHEMBL20704273 0.79 SLC6A2 (0.37) HTR2AHTR2C
SCHEMBL29516105 0.79 BRD4 (0.41) MEN1KMT2AKDM4E
SCHEMBL30561505 0.79 SLC6A2 (0.37) HTR2AHTR2C
SCHEMBL26792092 0.78 HPGD (0.41) NPSR1HPGDGFERHSD17B10ALDH1A1
SCHEMBL25691515 0.77 GABRA1 (0.35) KDM4E

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 5 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-20230159540-A1 PYRAZOLO[3,4-d]PYRIMIDIN-3-ONE DERIVATIVE AS WEE-1 INHIBITOR PYRAZOLO[3,4-D]PYRIMIDIN-3-ONE DERIVATIVE AS WEE-1 INHIBITOR (CN) 2023-05-25 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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 NPSR1 891/4885HPGD 506/4885GFER 1165/4885
US-11613527-B2 Enzyme inhibitors SERPINB1, KLKB1, SERPINE1 NPSR1 891/4885HPGD 506/4885GFER 1165/4885
US-20230159540-A1 PYRAZOLO[3,4-d]PYRIMIDIN-3-ONE DERIVATIVE AS WEE-1 INHIBITOR WEE1, WEE2, PEAK1 NPSR1 3227/4885HPGD 1844/4885GFER 4642/4885
US-20220048894-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 NPSR1 891/4885HPGD 506/4885GFER 1165/4885

“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.