SCHEMBL24253246

SCHEMBL24253246

CCCCCCCC(CCCCCCC)n1ccc(C#N)n1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.35
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GRM2 Q14416 2/20 0.32
SLC2A1 P11166 1/20 0.31

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
SCHEMBL22255172 0.78 LMNA (0.34) KDM4EHTT
SCHEMBL24309296 0.73 MGAT2 (0.42) CYP19A1ALDH1A1KDM4EHPGDHTT
SCHEMBL24253420 0.73 IDH1 (0.36) KDM4EHTT
SCHEMBL24253461 0.73 NPC1 (0.39) ALDH1A1HPGDL3MBTL1TSHRHSD17B10
SCHEMBL8855687 0.71 MGAT2 (0.41) CYP19A1ALDH1A1KDM4EHPGDHTT
SCHEMBL20898646 0.71 ADA (0.36) ALDH1A1
SCHEMBL26546592 0.70 JAK2 (0.42) CYP19A1JAK2JAK1ALDH1A1KDM4E
SCHEMBL5569537 0.69 MGAT2 (0.37) CYP19A1ALDH1A1TSHRGRM2
SCHEMBL21166004 0.69 CNR2 (0.33) CYP19A1ALDH1A1KDM4EHPGDHTT
SCHEMBL24253435 0.68 CYP19A1 (0.41) CYP19A1JAK2JAK1ALDH1A1KDM4E

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 3 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-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 (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 CYP19A1 275/4885JAK2 2866/4885JAK1 2470/4885
US-11613527-B2 Enzyme inhibitors SERPINB1, KLKB1, SERPINE1 CYP19A1 275/4885JAK2 2866/4885JAK1 2470/4885
US-20220048894-A1 ENZYME INHIBITORS SERPINB1, KLKB1, SERPINE1 CYP19A1 275/4885JAK2 2866/4885JAK1 2470/4885

“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.