SCHEMBL30200026

SCHEMBL30200026

FC1(F)CNc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.39
BACE1 P56817 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
PDK2 Q15119 2/20 0.33
PDK4 Q16654 1/20 0.33
GAA P10253 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPK1 P28482 2/20 0.32
POLB P06746 1/20 0.32
PDE7A Q13946 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 2/20 0.31
AKR1B1 P15121 1/20 0.31
HTR5A P47898 1/20 0.31
AHR P35869 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 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
SCHEMBL20815887 1.00 KDM1A (0.39) KDM1ABACE1OPRM1OPRL1PDK2
SCHEMBL16972026 0.78 KDM1A (0.37) KDM1ABACE1OPRM1OPRL1PDK2
SCHEMBL8271540 0.75 KDM1A (0.46) KDM1ABACE1OPRM1GAAMEN1
SCHEMBL25231375 0.74 TNKS (0.40) KDM1ABACE1OPRM1OPRL1PDE7A
SCHEMBL29384370 0.73 PDK2 (0.42) KDM1ABACE1OPRM1OPRL1PDK2
SCHEMBL29479467 0.73 TNKS (0.44) KDM1ABACE1OPRM1OPRL1PDK2
SCHEMBL27408376 0.73 KDM1A (0.39) KDM1ABACE1OPRM1OPRL1PDK2
SCHEMBL1012828 0.73 TNKS (0.44) KDM1ABACE1OPRM1OPRL1PDK2
SCHEMBL1031209 0.73 PDK2 (0.42) KDM1ABACE1OPRM1OPRL1PDK2
Hydrochloric Acid SCHEMBL2482151 0.71 PDK2 (0.41) KDM1ABACE1OPRM1OPRL1PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117946103-A Preparation method of chiral quaternary carbon-containing 3, 3-difluoroindole compound 云南民族大学 2024-04-30 CN claimed
US-12286429-B2 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide derivatives useful as a factor XIa inhibitors JANSSEN PHARMACEUTICA NV (BE) 2025-04-29 US disclosed
CN-117946103-A Preparation method of chiral quaternary carbon-containing 3, 3-difluoroindole compound 云南民族大学 2024-04-30 CN disclosed
US-20230064443-A1 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide Derivatives Useful As a Factor XIa Inhibitors JANSSEN PHARMACEUTICA NV (BE) 2023-03-02 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-12286429-B2 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide derivatives useful as a factor XIa inhibitors F11, F12, F13A1 KDM1A 428/4885BACE1 1909/4885OPRM1 2452/4885
US-20230064443-A1 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide Derivatives Useful As a Factor XIa Inhibitors F11, F12, F13A1 KDM1A 461/4885BACE1 1719/4885OPRM1 2133/4885

“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.