SCHEMBL25819721

SCHEMBL25819721

CNCCCc1cc(CO)cc(OCC2CCCCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
SIGMAR1 Q99720 1/20 0.37
PARP10 Q53GL7 5/20 0.36
PARP15 Q460N3 4/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
SLC2A1 P11166 1/20 0.35
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
HPGD P15428 1/20 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
SCHEMBL4568841 0.86 CHRNB2 (0.41) THRATHRBPARP10PARP15CNR1
SCHEMBL2207625 0.83 PARP10 (0.42) THRATHRBPARP10PARP15
SCHEMBL25819727 0.82 PARP10 (0.41) THRATHRBPARP10PARP15SLC2A1
SCHEMBL19291800 0.81 CHRM2 (0.47) CARM1PRMT6SLC2A1ACACBACACA
SCHEMBL25819673 0.81 CHRM2 (0.47) CARM1PRMT6SLC2A1ACACBACACA
SCHEMBL2204692 0.81 CHRM2 (0.47) CARM1PRMT6SLC2A1ACACBACACA
SCHEMBL4569120 0.81 PARP10 (0.38) THRATHRBPARP10PARP15ACACB
SCHEMBL25819677 0.80 CHRM2 (0.48) CARM1PRMT6SLC2A1ACACBACACA
SCHEMBL25819791 0.78 CHRM2 (0.46) SIGMAR1CARM1PRMT6SLC2A1ACACB
SCHEMBL25819702 0.76 KMT2A (0.44) CARM1PRMT6SLC2A1ACACBACACA

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 THRA 3146/4885THRB 2187/4885SIGMAR1 3489/4885

“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.