SCHEMBL23009261

SCHEMBL23009261

O=C1Cc2ccc3ccccc3c2C=C1C(=O)N1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 3/20 0.47
GAA P10253 3/20 0.47
GLA P06280 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
RAB9A P51151 6/20 0.46
NPC1 O15118 5/20 0.46
HTT P42858 2/20 0.42
ATM Q13315 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
POLB P06746 4/20 0.40
LMNA P02545 3/20 0.40
TP53 P04637 2/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL9681752 0.70 ANPEP (0.42) HPGDALDH1A1KDM4ETDP1HSD17B10
SCHEMBL6430908 0.67 ALDH1A1 (0.68) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL28570849 0.65 ALDH1A1 (0.66) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL11360223 0.65 ALDH1A1 (0.66) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL25247976 0.65 ALDH1A1 (0.66) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL28394623 0.65 ALDH1A1 (0.66) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL8407368 0.65 ALDH1A1 (0.66) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL14720666 0.65 ALDH1A1 (0.66) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL11335881 0.65 HPGD (0.63) HPGDMAPTALDH1A1KDM4EGAA
SCHEMBL2055409 0.65 HPGD (0.63) HPGDMAPTALDH1A1KDM4EGAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210047278-A1 E3 UBIQUITIN LIGASE AGONISTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE E3 UBIQUITIN LIGASE AGONISTS, RELATED METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-02-18 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-20210047278-A1 E3 UBIQUITIN LIGASE AGONISTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE E3 UBIQUITIN LIGASE AGONISTS, RELATED METHODS OF USE UBE3A, NEDD4, ADRM1 HPGD 2044/4885MAPT 1430/4885ALDH1A1 1174/4885

“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.