SCHEMBL25819602

SCHEMBL25819602

CNCCC(=O)c1cccc(OCC2(O)CCCCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
ADRA1A P35348 1/20 0.39
OPRM1 P35372 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KCNH2 Q12809 1/20 0.39
GAA P10253 1/20 0.38
ABCB1 P08183 3/20 0.38
CTNNB1 P35222 2/20 0.37
WNT3A P56704 2/20 0.37

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
SCHEMBL20332367 0.89 TP53 (0.44) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL18539800 0.89 TP53 (0.44) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL13881682 0.88 TP53 (0.43) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL18550912 0.87 MTNR1A (0.43) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL3969117 0.87 TP53 (0.43) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL4568759 0.87 THRA (0.46) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL4568757 0.87 THRA (0.46) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL2204207 0.85 TP53 (0.41) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL2208271 0.85 TP53 (0.41) TP53HPGDRAB9ASMN1; SMN2THRA
SCHEMBL4569027 0.85 THRA (0.47) TP53HPGDRAB9ASMN1; SMN2THRA

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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER TP53 4120/4885HPGD 110/4885RAB9A 2078/4885

“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.