SCHEMBL22890922

SCHEMBL22890922

CCC(C)OCCCN1CCC[C@@H](O)C1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.51
HRH3 Q9Y5N1 10/20 0.45
HRH2 P25021 3/20 0.45
HRH1 P35367 3/20 0.45
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
BCHE P06276 1/20 0.36
MAOB P27338 1/20 0.35

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
SCHEMBL22861398 1.00 HTR1A (0.51) HTR1AHRH3HRH2HRH1KDM4E
SCHEMBL13542804 0.91 HRH3 (0.46) HTR1AHRH3HRH2HRH1
SCHEMBL13543540 0.91 HRH3 (0.46) HTR1AHRH3HRH2HRH1
SCHEMBL22281966 0.87 HTR1A (0.54) HTR1AHRH3HRH2HRH1KDM4E
SCHEMBL20729452 0.87 HTR1A (0.54) HTR1AHRH3HRH2HRH1KDM4E
SCHEMBL20729427 0.87 HTR1A (0.54) HTR1AHRH3HRH2HRH1KDM4E
SCHEMBL21376977 0.85 GLB1 (0.38) HTR1AHRH3HRH2HRH1
SCHEMBL22890929 0.82 HRH3 (0.41) HRH3HRH2HRH1ALDH1A1MAOB
SCHEMBL27447200 0.81 HTR1A (0.49) HTR1AHRH3HRH2HRH1BCHE
SCHEMBL24497793 0.81 HTR1A (0.49) HTR1AHRH3HRH2HRH1KDM4E

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-11702429-B2 mTORC modulators and uses thereof AEOVIAN PHARMACEUTICALS, INC. (US) 2023-07-18 US disclosed
US-20230013344-A1 MTORC MODULATORS AND USES THEREOF EVOTEC (FRANCE) SAS (FR) 2023-01-19 US disclosed
US-11230557-B2 mTORC modulators and uses thereof AEOVIAN PHARMACEUTICALS, INC. (US) 2022-01-25 US disclosed
US-20210008041-A1 MTORC MODULATORS AND USES THEREOF AEOVIAN PHARMACEUTICALS, INC. 2021-01-14 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 (4 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-11702429-B2 mTORC modulators and uses thereof MTOR, RICTOR, RPTOR HTR1A 4040/4885HRH3 3363/4885HRH2 3574/4885
US-20210008041-A1 MTORC MODULATORS AND USES THEREOF MTOR, RICTOR, RPTOR HTR1A 4040/4885HRH3 3363/4885HRH2 3574/4885
US-11230557-B2 mTORC modulators and uses thereof MTOR, RICTOR, RPTOR HTR1A 4040/4885HRH3 3363/4885HRH2 3574/4885
US-20230013344-A1 MTORC MODULATORS AND USES THEREOF MTOR, RICTOR, RPTOR HTR1A 4040/4885HRH3 3363/4885HRH2 3574/4885

“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.