SCHEMBL14425219

SCHEMBL14425219

COc1ccc(Nc2cc3c(cc2C)C(C)(C)CCC3(C)C)ccc1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FPR1 P21462 1/20 0.37
▸ GNRHR P30968 1/20 0.37
▸ GPR183 P32249 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.37
▸ RXRA P19793 6/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ CYP26A1 O43174 6/20 0.36
▸ CYP26B1 Q9NR63 2/20 0.36
▸ RARA P10276 1/20 0.36
▸ RARB P10826 1/20 0.36
▸ RARG P13631 1/20 0.36
▸ EGFR P00533 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ CDC25A P30304 1/20 0.35
▸ CDC25B P30305 1/20 0.35

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
SCHEMBL14425213 0.83 TSHR (0.44) RXRAMAPTMAPK1GAATSHR
SCHEMBL14425218 0.82 CYP26A1 (0.40) RXRAMAPK1TSHRCYP26A1CYP26B1
SCHEMBL28481448 0.79 EGFR (0.42) GNRHRRXRAMAPTGAACYP26A1
SCHEMBL17049086 0.78 CYP3A4 (0.51) RXRAMAPTMAPK1HSD17B10TSHR
SCHEMBL23371572 0.76 CYP26A1 (0.44) RXRAMAPK1TSHRCYP26A1CYP26B1
SCHEMBL22836804 0.75 RXRA (0.62) RXRAMAPK1TSHRCYP26A1CYP26B1
SCHEMBL23439027 0.74 CYP26A1 (0.46) RXRACYP26A1CYP26B1RARARARB
SCHEMBL24562676 0.74 RXRA (0.42) RXRAGAACYP26A1CYP26B1RARA
SCHEMBL23927691 0.73 RXRA (0.41) RXRACYP26A1CYP26B1RARARARB
SCHEMBL14425217 0.73 RXRA (0.60) FPR1GNRHRGPR183GPR119RXRA

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-7259187-B2 Tropolone derivatives RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2007-08-21 — — US disclosed
US-7259187-B2 Tropolone derivatives RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2007-08-21 — — US disclosed
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