SCHEMBL29890877

SCHEMBL29890877

CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)C1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
RECQL P46063 1/20 0.47
EPHX1 P07099 1/20 0.47
MAPT P10636 2/20 0.45
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
GPR119 Q8TDV5 4/20 0.43
NR1H2 P55055 1/20 0.43
PDE4B Q07343 1/20 0.43
KDM4E B2RXH2 1/20 0.43
THRB P10828 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43

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
SCHEMBL24113030 1.00 HPGD (0.49) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL28850128 1.00 HPGD (0.49) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL31556728 0.90 MEN1 (0.52) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL28994850 0.90 HPGD (0.49) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL24766583 0.90 HPGD (0.49) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL30540076 0.90 HPGD (0.49) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL24766074 0.90 HPGD (0.49) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL1262547 0.90 HPGD (0.55) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL28683024 0.87 HPGD (0.47) HPGDRECQLEPHX1MAPTUSP2
SCHEMBL2625518 0.86 HPGD (0.51) HPGDRECQLEPHX1MAPTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12336991-B2 Factor XIIA inhibitors UNIVERSITY OF LEEDS (GB) 2025-06-24 US disclosed
US-20220305011-A1 FACTOR XIIA INHIBITORS UNIVERSITY OF LEEDS (GB) 2022-09-29 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 (2 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-20220305011-A1 FACTOR XIIA INHIBITORS F11, F13B, F12 HPGD 675/4885RECQL 1842/4885EPHX1 382/4885
US-12336991-B2 Factor XIIA inhibitors F11, F13B, F12 HPGD 675/4885RECQL 1842/4885EPHX1 382/4885

“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.