SCHEMBL178792

SCHEMBL178792

CCC(C)(C(F)(F)F)C(F)(F)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL19578687 0.88 TSHR (0.32) TSHRTDP1
SCHEMBL6677553 0.85 TSHR (0.33) TSHRTDP1
SCHEMBL22571421 0.84 TSHR (0.38) TSHRTDP1
SCHEMBL17864193 0.83
SCHEMBL14316906 0.82 TSHR (0.32) TSHRTDP1
SCHEMBL24473307 0.81 TSHR (0.40) TSHRTDP1
SCHEMBL6681271 0.81 TSHR (0.40) TSHRTDP1
SCHEMBL13265241 0.80 TSHR (0.30) TSHRTDP1
SCHEMBL178836 0.80 TSHR (0.30) TSHRTDP1
SCHEMBL19578702 0.78

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120251471-A1 HAIR CARE COMPOSITIONS AND METHODS OF TREATING HAIR USING SAME LIVING PROOF, INC. (US) 2012-10-04 US disclosed
US-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2012-03-08 US disclosed
EP-2207832-B1 COMPOSITIONS COMPRISING FLUORINE-CONTAINING POLYMER AND SILOXANE HUNTSMAN TEXTILE EFFECTS GER (DE) 2011-11-16 EP 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 (2 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-20120251471-A1 HAIR CARE COMPOSITIONS AND METHODS OF TREATING HAIR USING SAME TET1, TET2, TET3 TSHR 3749/4885TDP1 1217/4885
US-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use INCENP, CYBA, ADCY5 TSHR 4806/4885TDP1 2329/4885

“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.