SCHEMBL25211795

SCHEMBL25211795

Cc1cc(Br)ccc1CN(C)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.46
AAK1 Q2M2I8 3/20 0.40
SOS1 Q07889 1/20 0.40
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2C P28335 4/20 0.38
SLC6A4 P31645 4/20 0.38
CACNA1G O43497 1/20 0.37
CACNA1B Q00975 1/20 0.37
CACNA1C Q13936 1/20 0.37
RIPK1 Q13546 2/20 0.36
FPR3 P25089 1/20 0.36
FPR2 P25090 1/20 0.36
HTR2A P28223 1/20 0.36
RAB9A P51151 1/20 0.36
NCEH1 Q6PIU2 1/20 0.35
HSP90AA1 P07900 1/20 0.34

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
SCHEMBL31163069 0.90 POLB (0.42) PYCR1AAK1SOS1POLBMEN1
SCHEMBL20054017 0.90 POLB (0.42) PYCR1AAK1SOS1POLBMEN1
SCHEMBL8168487 0.86 FPR3 (0.39) PYCR1AAK1SOS1MEN1KMT2A
SCHEMBL18719607 0.86 POLB (0.43) AAK1SOS1POLBMEN1KMT2A
SCHEMBL12068165 0.85 RIPK1 (0.47) PYCR1AAK1SOS1POLBHTR2C
SCHEMBL31137753 0.85 RIPK1 (0.47) PYCR1AAK1SOS1POLBHTR2C
SCHEMBL2884008 0.84 HPGD (0.43) AAK1SOS1POLBMEN1KMT2A
SCHEMBL29211248 0.83 ALDH1A1 (0.43) AAK1SOS1POLBMEN1KMT2A
SCHEMBL12231498 0.82 HTR2C (0.39) HTR2CSLC6A4CACNA1GCACNA1BCACNA1C
SCHEMBL20461244 0.81 POLB (0.40) AAK1SOS1POLBMEN1KMT2A

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
US-20240327380-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2024-10-03 US disclosed
CN-116917279-A BTK inhibitors 渤健马萨诸塞州股份有限公司 2023-10-20 CN disclosed
EP-4192587-A1 BTK INHIBITORS Biogen MA Inc. (US) 2023-06-14 EP disclosed
WO-2022032019-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2022-02-10 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-20240327380-A1 BTK INHIBITORS BTK, SYK, LYN PYCR1 4152/4885AAK1 706/4885SOS1 2506/4885

“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.