SCHEMBL29310080

SCHEMBL29310080

COCC1CN(C)CCN1c1ccc(C(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2D6 P10635 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
BCHE P06276 2/20 0.32
MAOB P27338 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
GRM2 Q14416 1/20 0.32
MAPT P10636 1/20 0.32
FPR1 P21462 1/20 0.32
FPR2 P25090 1/20 0.32
ACHE P22303 2/20 0.32

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
SCHEMBL29310314 0.86 KDM4E (0.44) MEN1KMT2AHRH3L3MBTL1CYP2D6
SCHEMBL29310082 0.84 GCKR (0.37) MEN1KMT2AHTR2AHTR2CHRH3
SCHEMBL27372187 0.84 MAPT (0.42) MEN1KMT2AHRH3L3MBTL1CYP2D6
SCHEMBL12701192 0.82 MAPK1 (0.42) MEN1KMT2AHTR2AHTR2CHRH3
SCHEMBL189028 0.80 CYP2D6 (0.32) HRH3CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL29310315 0.77 SIRT6 (0.50) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL24451883 0.77 SLC6A2 (0.56) HTR2CCYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL29310074 0.76 L3MBTL1 (0.41) HTR2AHTR2CHRH3L3MBTL1HPGD
SCHEMBL29310070 0.76 L3MBTL1 (0.41) HTR2AHTR2CHRH3L3MBTL1HPGD
SCHEMBL25839399 0.76 L3MBTL1 (0.41) HTR2AHTR2CHRH3L3MBTL1HPGD

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-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2024-07-11 US disclosed
US-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. 2024-07-11 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-20240228459-A1 WEE1 INHIBITORS AND USES THEREOF WEE1, WEE2, DCLRE1B MEN1 1813/4885KMT2A 1422/4885HTR2A 4557/4885

“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.