SCHEMBL23914560

SCHEMBL23914560

CC(C)c1cccc(Oc2ccc(C(F)(F)F)cn2)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.66
THRB P10828 1/20 0.53
TSHR P16473 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 1/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.47
RAB9A P51151 1/20 0.47
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LIPE Q05469 3/20 0.46
IDO1 P14902 1/20 0.45
SCN9A Q15858 5/20 0.45

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
SCHEMBL15132941 0.83 LMNA (0.59) MAPK1THRBTSHRSMN1; SMN2LMNA
SCHEMBL13160074 0.83 KDM4E (0.48) MAPK1TSHRSMN1; SMN2ALDH1A1POLB
SCHEMBL20381754 0.82 MAPK1 (0.71) MAPK1THRBTSHRSMN1; SMN2ALDH1A1
SCHEMBL6531818 0.82 MAPK1 (0.75) MAPK1THRBTSHRSMN1; SMN2ALDH1A1
SCHEMBL4198448 0.81 MAPK1 (0.56) MAPK1THRBTSHRSMN1; SMN2ALDH1A1
SCHEMBL30334879 0.79 MAPK1 (0.67) MAPK1THRBTSHRSMN1; SMN2ALDH1A1
SCHEMBL1979734 0.79 KDM4E (0.67) MAPK1TSHRSMN1; SMN2ALDH1A1POLB
SCHEMBL1011398 0.79 THRB (0.72) MAPK1THRBTSHRSMN1; SMN2ALDH1A1
SCHEMBL10500983 0.79 MAPK1 (0.67) MAPK1THRBTSHRSMN1; SMN2ALDH1A1
SCHEMBL5651111 0.79 MAPK1 (0.67) MAPK1THRBTSHRSMN1; SMN2ALDH1A1

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-20210317160-A1 3,4-THIAZOLO-STEROIDS AND METHODS OF MAKING AND USING THE SAME Arkansas State University - Jonesboro 2021-10-14 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-20210317160-A1 3,4-THIAZOLO-STEROIDS AND METHODS OF MAKING AND USING THE SAME HSD17B7, HSD17B3, NR3C2 MAPK1 3636/4885THRB 404/4885TSHR 393/4885

“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.