SCHEMBL22890965

SCHEMBL22890965

CCCCCC(C)OCCCOCCO

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
THRB P10828 1/20 0.55
HTT P42858 1/20 0.55
MAPT P10636 1/20 0.55
USP2 O75604 2/20 0.37
MAPK1 P28482 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
CYP3A4 P08684 1/20 0.36
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLCO1B3 Q9NPD5 1/20 0.36
SLCO1B1 Q9Y6L6 1/20 0.36
FAAH O00519 3/20 0.35
LPAR1 Q92633 3/20 0.34
LPAR3 Q9UBY5 3/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 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
SCHEMBL2263661 0.91 MEN1 (0.57) TSHRMEN1KMT2ATHRBHTT
SCHEMBL2266299 0.91 MEN1 (0.57) TSHRMEN1KMT2ATHRBHTT
SCHEMBL29908275 0.91 MEN1 (0.57) TSHRMEN1KMT2ATHRBHTT
SCHEMBL2264265 0.91 MEN1 (0.57) TSHRMEN1KMT2ATHRBHTT
SCHEMBL29521238 0.91 MEN1 (0.57) TSHRMEN1KMT2ATHRBHTT
SCHEMBL11659395 0.89 MEN1 (0.60) TSHRMEN1KMT2ATHRBHTT
SCHEMBL4592663 0.89 MEN1 (0.60) TSHRMEN1KMT2ATHRBHTT
SCHEMBL11060042 0.89 MEN1 (0.60) TSHRMEN1KMT2ATHRBHTT
SCHEMBL5316580 0.89 MEN1 (0.60) TSHRMEN1KMT2ATHRBHTT
SCHEMBL14169158 0.89 MEN1 (0.60) TSHRMEN1KMT2ATHRBHTT

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
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 (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-20210008041-A1 MTORC MODULATORS AND USES THEREOF MTOR, RICTOR, RPTOR TSHR 3270/4885MEN1 1893/4885KMT2A 3291/4885
US-11230557-B2 mTORC modulators and uses thereof MTOR, RICTOR, RPTOR TSHR 3270/4885MEN1 1893/4885KMT2A 3291/4885

“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.