SCHEMBL15836629

SCHEMBL15836629

Cc1cc(C)c2oc(=O)cc(CN3CCN(Cc4ccc5c(c4)OCO5)CC3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 5/20 1.00
TSHR P16473 4/20 1.00
RAB9A P51151 2/20 1.00
ALDH1A1 P00352 4/20 0.74
GAA P10253 2/20 0.74
MAPK1 P28482 1/20 0.74
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
LMNA P02545 3/20 0.71
NPSR1 Q6W5P4 2/20 0.71
POLB P06746 4/20 0.70
SMN1; SMN2 Q16637 2/20 0.68
TP53 P04637 2/20 0.64
MAPT P10636 1/20 0.51
NPC1 O15118 1/20 0.51

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
SCHEMBL15836703 0.85 USP2 (1.00) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL12473499 0.83 KMT2A (1.00) USP2TSHRRAB9AALDH1A1MEN1
SCHEMBL15836698 0.83 USP2 (1.00) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL6191409 0.83 USP2 (0.70) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL15836704 0.81 USP2 (0.81) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL12473143 0.75 USP2 (0.74) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL15836705 0.75 MEN1 (0.72) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL15836633 0.74 TSHR (0.74) USP2TSHRRAB9AALDH1A1GAA
SCHEMBL108678 0.74 KDM4E (0.70) USP2TSHRMAPK1MEN1KMT2A
SCHEMBL2056152 0.73 KDM4E (0.62) USP2TSHRALDH1A1MAPK1MEN1

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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 US disclosed
US-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 USP2 1628/4885TSHR 3057/4885RAB9A 2629/4885

“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.