SCHEMBL23903305

SCHEMBL23903305

CC(C)(Oc1ccccc1)C(=O)N1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
LMNA P02545 4/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HSD11B1 P28845 1/20 0.50
NPSR1 Q6W5P4 3/20 0.48
MAPT P10636 2/20 0.48
HTT P42858 2/20 0.48
ALOX15 P16050 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
HPGD P15428 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47

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
SCHEMBL29516647 0.95 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
SCHEMBL22705629 0.89 LMNA (0.56) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
SCHEMBL25442326 0.86 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
SCHEMBL23903336 0.84 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
Hydrochloric Acid SCHEMBL7824677 0.83 SIGMAR1 (0.47) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
SCHEMBL24597769 0.83 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
SCHEMBL3567407 0.83 NPSR1 (0.56) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR
SCHEMBL4285382 0.82 GAA (0.50) ALDH1A1SMN1; SMN2LMNANPSR1MAPT
SCHEMBL25442179 0.82 KMT2A (0.45) ALDH1A1SMN1; SMN2LMNAHSD11B1NPSR1
SCHEMBL8020083 0.80 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2LMNAKDM4ETSHR

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-20230142739-A1 PROTEIN-PROTEIN INTERACTION STABILIZERS UNIV CALIFORNIA (US) 2023-05-11 US disclosed
WO-2021203016-A2 PROTEIN-PROTEIN INTERACTION STABILIZERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-07 WO 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-20230142739-A1 PROTEIN-PROTEIN INTERACTION STABILIZERS HSPBP1, HSPA8, HSPH1 ALDH1A1 3889/4885SMN1; SMN2 1672/4885LMNA 2827/4885

“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.