SCHEMBL8064458

SCHEMBL8064458

COc1ccc(COc2ccccc2C(O)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.53
ALDH1A1 P00352 2/20 0.53
SGMS2 Q8NHU3 2/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
DRD2 P14416 1/20 0.47
DRD1 P21728 1/20 0.47
RXRA P19793 1/20 0.46
ATM Q13315 2/20 0.45
HTR1A P08908 1/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
FFAR1 O14842 1/20 0.45
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL477534 0.87 DRD2 (0.55) ALDH1A1SGMS2LMNADRD2DRD1
SCHEMBL2580244 0.85 MAOB (0.55) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL2576276 0.84 LMNA (0.52) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL25750670 0.83 ABCB1 (0.53) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL25750618 0.83 ABCB1 (0.45) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL11723955 0.82 FFAR1 (0.57) NPC1RAB9AMEN1KMT2AFFAR1
SCHEMBL2572231 0.82 FFAR1 (0.48) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL2580792 0.82 FFAR1 (0.48) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL28769510 0.82 SGMS2 (0.56) ABCB1ALDH1A1SGMS2LMNAGAA
SCHEMBL1539311 0.82 LIPE (0.45) ALDH1A1SGMS2LMNAGAADRD2

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-20230212187-A1 FUSED RING DERIVATIVES AND USE THEREOF IN PHARMACY CISEN PHARMACEUTICAL CO., LTD (CN) 2023-07-06 US disclosed
US-6166072-A Amino acid derivatives ALLELIX NEUROSCIENCE, INC. (CA) 2000-12-26 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-20230212187-A1 FUSED RING DERIVATIVES AND USE THEREOF IN PHARMACY ABCB1, CYP3A43, CYP3A7 ABCB1 1/4885ALDH1A1 555/4885SGMS2 1296/4885

“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.