SCHEMBL20317296

SCHEMBL20317296

O=c1c2cc3cc(F)ccc3cc2oc2cccc(F)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 3/20 0.43
▸ POLB P06746 1/20 0.38
▸ AHR P35869 2/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ KDM5A P29375 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2A6 P11509 1/20 0.37
▸ MAOA P21397 2/20 0.36
▸ MAOB P27338 1/20 0.35
▸ TTR P02766 2/20 0.35
▸ GABRP O00591 1/20 0.34
▸ GABRD O14764 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ GABRB1 P18505 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ GABRA3 P34903 1/20 0.34
▸ GABRA2 P47869 1/20 0.34

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
SCHEMBL20317289 1.00 AR (0.43) ARPOLBAHRESR1KDM5A
SCHEMBL20317224 0.88 AR (0.45) ARPOLBAHRMAOAMAOB
SCHEMBL20317326 0.86 ALDH1A1 (0.39) ARAHRESR1KDM5AESR2
SCHEMBL20330051 0.84 MAOA (0.50) ESR1KDM5AESR2CYP1A2CYP2A6
SCHEMBL20317338 0.84 MAOA (0.58) ARPOLBESR1KDM5AESR2
SCHEMBL20317269 0.82 MAOA (0.55) POLBCYP1A2CYP2A6MAOATTR
SCHEMBL20317258 0.82 MAOA (0.55) POLBCYP1A2CYP2A6MAOATTR
SCHEMBL20317290 0.82 MAOA (0.42) AHRCYP1A2CYP2A6MAOATTR
SCHEMBL20317286 0.82 MAOA (0.42) AHRCYP1A2CYP2A6MAOATTR
SCHEMBL20346664 0.81 AR (0.44) ARAHRESR1KDM5AESR2

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-20180179174-A1 12H-BENZO[b]XANTHEN-12-ONES, COMPOSITIONS CONTAINING, AND USES OF, SAME THESAN PHARMACEUTICALS, INC. (US) 2018-06-28 — — US disclosed
US-20180179174-A1 12H-BENZO[b]XANTHEN-12-ONES, COMPOSITIONS CONTAINING, AND USES OF, SAME THESAN PHARMACEUTICALS, INC. (US) 2018-06-28 — — 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-20180179174-A1 12H-BENZO[b]XANTHEN-12-ONES, COMPOSITIONS CONTAINING, AND USES OF, SAME AHR, NR1H2, NR1H3 AR 211/4885POLB 2424/4885AHR 1/4885

“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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