SCHEMBL26030950

SCHEMBL26030950

CCOc1cc(C(=O)O)c(C)cc1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ CYP3A4 P08684 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ ADRA2B P18089 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ ADRA1D P25100 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ HRH1 P35367 1/20 0.41
▸ ADRA1B P35368 1/20 0.41
▸ DRD3 P35462 1/20 0.41

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
SCHEMBL26454606 0.88 RXRA (0.47) TP53CYP1A2ADRA2ACYP2D6PKM
SCHEMBL26031210 0.83 TSHR (0.51) TSHRHSD17B10CYP3A4LMNAPOLB
SCHEMBL15178962 0.79 MAPT (0.43) TSHRHSD17B10LMNAPOLBMAPT
SCHEMBL2625747 0.79 LMNA (0.47) TSHRHSD17B10LMNAPOLBMAPT
SCHEMBL29498876 0.78 RXRA (0.48) TSHRLMNAPOLBADRA2AADRA1A
SCHEMBL22235242 0.78 RXRA (0.48) TSHRLMNAPOLBADRA2AADRA1A
SCHEMBL27744380 0.77 ACE2 (0.46) TSHRHSD17B10POLBMAPTHPGD
SCHEMBL12941391 0.77 RXRA (0.51) POLBMAPTRXRARXRBRXRG
SCHEMBL2828736 0.77 TSHR (0.75) TSHRHSD17B10CYP3A4LMNAHPGD
SCHEMBL23793741 0.75 TSHR (0.64) TSHRLMNAPOLBRXRARXRB

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-20230265055-A1 STAT INIHIBITORY COMPOUNDS AND COMPOSITIONS OXFORD FINANCE LLC 2023-08-24 — — 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-20230265055-A1 STAT INIHIBITORY COMPOUNDS AND COMPOSITIONS STAT5B, STAT5A, STAT3 TSHR 1093/4885HSD17B10 3640/4885CYP3A4 4574/4885

“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.

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