SCHEMBL17212291

SCHEMBL17212291

Cc1sc2cc(CO)ccc2c1C1=C(c2c(C)sc3cc(CO)ccc23)C(F)(F)C(F)(F)C1(F)F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.36
▸ APP P05067 2/20 0.33
▸ ILK Q13418 2/20 0.33
▸ ALOX5 P09917 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31

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
SCHEMBL19361388 0.84 BCL2L1 (0.36) —
SCHEMBL2627660 0.81 ESR1 (0.39) —
SCHEMBL20527904 0.78 SMN1; SMN2 (0.40) —
SCHEMBL5688195 0.77 CA2 (0.35) APP
SCHEMBL5089766 0.77 ESR1 (0.36) —
SCHEMBL5091528 0.76 TSHR (0.39) HSD17B10
SCHEMBL29492999 0.74 GPR3 (0.39) HSD17B10
SCHEMBL392860 0.74 GPR3 (0.39) HSD17B10
SCHEMBL3858215 0.73 SMN1; SMN2 (0.42) —
SCHEMBL7104988 0.72 CYP1A2 (0.37) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738675-B2 Water-soluble photochromic compound RIKKYO EDUCATIONAL CORPORATION (JP) 2017-08-22 — — US disclosed
US-9738675-B2 Water-soluble photochromic compound RIKKYO EDUCATIONAL CORPORATION (JP) 2017-08-22 — — US disclosed
US-20150307541-A1 WATER-SOLUBLE PHOTOCHROMIC MOLECULES RIKKYO EDUCATIONAL CORPORATION (JP) 2015-10-29 — — US disclosed
US-20150307541-A1 WATER-SOLUBLE PHOTOCHROMIC MOLECULES RIKKYO EDUCATIONAL CORPORATION (JP) 2015-10-29 — — 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-20150307541-A1 WATER-SOLUBLE PHOTOCHROMIC MOLECULES SLC2A3, CCND3, MRPS23 HSD17B10 1255/4885APP 3852/4885ILK 2169/4885

“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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