SCHEMBL29902875

SCHEMBL29902875

CCNC(=O)C(C)N1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.53
MAPK1 P28482 1/20 0.51
AAK1 Q2M2I8 1/20 0.44
ALDH1A1 P00352 4/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TSHR P16473 1/20 0.41
CAPN1 P07384 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL28800785 0.79 AAK1 (0.47) MAPK1AAK1ALDH1A1LMNAMAPT
SCHEMBL18687290 0.79 AAK1 (0.47) MAPK1AAK1ALDH1A1LMNAMAPT
SCHEMBL18612438 0.79 HTT (0.46) HTTMAPK1ALDH1A1LMNAMAPT
SCHEMBL6678936 0.79 SIGMAR1 (0.58) HTTMAPK1KMT2ASMN1; SMN2KDM4E
SCHEMBL4419679 0.78 POLB (0.54) MAPK1AAK1ALDH1A1LMNAMAPT
SCHEMBL19022016 0.77 SIGMAR1 (0.43) MAPK1ALDH1A1KMT2ANPSR1SMN1; SMN2
SCHEMBL30067025 0.77 TSHR (0.47) HTTMAPK1AAK1ALDH1A1TSHR
SCHEMBL7969101 0.76 ALDH1A1 (0.46) HTTMAPK1AAK1ALDH1A1LMNA
SCHEMBL12283489 0.76 ALDH1A1 (0.46) HTTMAPK1AAK1ALDH1A1LMNA
SCHEMBL21251239 0.75 HTT (0.41) HTTMAPK1AAK1ALDH1A1LMNA

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
US-11661419-B2 Benzimidazole derivative compounds and uses thereof PFIZER INC. (US) 2023-05-30 US claimed
CN-115087655-A Benzimidazole derivatives 辉瑞公司 2022-09-20 CN claimed
US-20240124439-A1 Pyrido[2,3-D]Imidazole Derivatives and Their Use As Inhibitors of ITK for the Treatment of Skin Disease PFIZER INC. (US) 2024-04-18 US disclosed
EP-4077316-A1 BENZIMIDAZOLE DERIVATIVES Pfizer Inc. (US) 2022-10-26 EP disclosed
CN-115087655-A Benzimidazole derivatives 辉瑞公司 2022-09-20 CN 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-20240124439-A1 Pyrido[2,3-D]Imidazole Derivatives and Their Use As Inhibitors of ITK for the Treatment of Skin Disease ITK, PDXK, HRH4 HTT 4786/4885MAPK1 955/4885AAK1 457/4885
US-11661419-B2 Benzimidazole derivative compounds and uses thereof ITK, HRH4, BLK HTT 4108/4885MAPK1 1399/4885AAK1 521/4885

“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.