SCHEMBL22015105

SCHEMBL22015105

Fc1ccc(N2C[C@H]3CNC[C@H]3C2)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.66
CHRNB2 P17787 3/20 0.49
CHRNA4 P43681 3/20 0.49
CHRNA7 P36544 2/20 0.49
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
GFER P55789 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NOTUM Q6P988 1/20 0.41
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL16423974 1.00 BPTF (0.66) BPTFCHRNB2CHRNA4CHRNA7ALDH1A1
SCHEMBL27031079 1.00 BPTF (0.66) BPTFCHRNB2CHRNA4CHRNA7ALDH1A1
Hydrochloric Acid SCHEMBL17134678 0.98 BPTF (0.63) BPTFCHRNB2CHRNA4CHRNA7ALDH1A1
SCHEMBL22728546 0.83 BPTF (0.50) BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL29732584 0.83 BPTF (0.50) BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL13783969 0.81 ALDH1A1 (0.47) BPTFALDH1A1LMNAMAPTMAPK1
SCHEMBL24495224 0.80 BPTF (0.66) BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL22015317 0.80 BPTF (0.66) BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL20510583 0.80 BPTF (0.66) BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL22523821 0.80 BPTF (0.66) BPTFCHRNB2CHRNA4CHRNA7ALDH1A1

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
EP-4472963-A1 DGK TARGETING COMPOUNDS AND USES THEREOF Arvinas Operations, Inc. (US) 2024-12-11 EP disclosed
CN-113365984-B LOX inhibitors 癌症研究协会皇家癌症医院 2024-10-15 CN disclosed
WO-2023150186-A1 DGK TARGETING COMPOUNDS AND USES THEREOF ARVINAS OPERATIONS, INC. (US) 2023-08-10 WO disclosed
US-20220017516-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-01-20 US disclosed
WO-2020099886-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-05-22 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 (1 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-20220017516-A1 LOX INHIBITORS LOXL1, LOX, LOXL2 BPTF 3130/4885CHRNB2 3882/4885CHRNA4 4539/4885

“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.