SCHEMBL24925819

SCHEMBL24925819

CCC(=O)N1CCCCc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
TSHR P16473 2/20 0.62
LMNA P02545 2/20 0.62
MAPK1 P28482 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
NOTUM Q6P988 1/20 0.62
KDM4E B2RXH2 1/20 0.62
POLB P06746 1/20 0.62
PKM P14618 1/20 0.62
AVPR2 P30518 2/20 0.61
OXTR P30559 2/20 0.61
AVPR1A P37288 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
KMT2A Q03164 3/20 0.60
GAA P10253 1/20 0.57
MEN1 O00255 2/20 0.56
MAPT P10636 1/20 0.56

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
SCHEMBL3660180 0.95 NOTUM (0.69) ALDH1A1TSHRLMNAMAPK1NPSR1
SCHEMBL29520673 0.95 NOTUM (0.69) ALDH1A1TSHRLMNAMAPK1NPSR1
Hydrochloric Acid SCHEMBL29520826 0.94 NOTUM (0.67) ALDH1A1TSHRLMNAMAPK1NPSR1
Hydrochloric Acid SCHEMBL29521106 0.94 NOTUM (0.67) ALDH1A1TSHRLMNAMAPK1NPSR1
SCHEMBL5006023 0.89 TSHR (0.75) ALDH1A1TSHRMAPK1NOTUMPOLB
SCHEMBL5398751 0.86 ALDH1A1 (0.63) ALDH1A1TSHRNOTUMKDM4EPOLB
SCHEMBL9559719 0.84 ALDH1A1 (0.62) ALDH1A1TSHRNOTUMKDM4EPOLB
SCHEMBL25937310 0.84 ALDH1A1 (0.62) ALDH1A1TSHRNOTUMKDM4EPOLB
SCHEMBL25430987 0.84 ALDH1A1 (0.62) ALDH1A1TSHRNOTUMKDM4EPOLB
SCHEMBL29522633 0.83 TSHR (0.67) ALDH1A1TSHRMAPK1NOTUMKDM4E

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
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 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 (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-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 ALDH1A1 1598/4885TSHR 1190/4885LMNA 816/4885

“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.