SCHEMBL10655414

SCHEMBL10655414

O=C1Oc2cc3ccccc3c3cccc1c23

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 10/20 0.56
▸ MAPK1 P28482 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ HIF1A Q16665 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ MEN1 O00255 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CES1 P23141 1/20 0.45
▸ MAOA P21397 2/20 0.43
▸ MAOB P27338 1/20 0.43
▸ ERBB2 P04626 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ AHR P35869 1/20 0.43

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
SCHEMBL9041820 0.84 ALDH1A1 (0.63) TYMSMAPK1ALDH1A1HPGDTSHR
SCHEMBL15600432 0.82 MAPK1 (0.61) TYMSMAPK1ALDH1A1HPGDTSHR
SCHEMBL15893312 0.76 ALDH1A1 (0.49) TYMSMAPK1ALDH1A1HPGDTSHR
SCHEMBL16883560 0.76 ALDH1A1 (0.49) MAPK1ALDH1A1HPGDTSHRCASP1
SCHEMBL15600543 0.76 ALDH1A1 (0.49) MAPK1ALDH1A1HPGDTSHRCASP1
SCHEMBL20151723 0.75 ALDH1A1 (0.61) TYMSMAPK1ALDH1A1HPGDTSHR
SCHEMBL15600575 0.74 MAPK1 (0.47) MAPK1ALDH1A1HPGDTSHRCASP1
SCHEMBL580216 0.74 CES1 (0.65) TYMSMAPK1ALDH1A1HPGDTSHR
SCHEMBL15856976 0.73 ALDH1A1 (0.46) MAPK1ALDH1A1HPGDTSHRCASP1
SCHEMBL15600574 0.73 ALDH1A1 (0.46) MAPK1ALDH1A1HPGDTSHRCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108403689-A The purposes and the application in terms of oncotherapy that radix aristolochiae heterophyllae phenanthrene lactone B lowers FoxM1 genes 李世龙 2018-08-17 — — CN claimed
CN-108403689-A The purposes and the application in terms of oncotherapy that radix aristolochiae heterophyllae phenanthrene lactone B lowers FoxM1 genes 李世龙 2018-08-17 — — CN disclosed
CN-108403689-A The purposes and the application in terms of oncotherapy that radix aristolochiae heterophyllae phenanthrene lactone B lowers FoxM1 genes 李世龙 2018-08-17 — — CN disclosed
CN-108403689-A The purposes and the application in terms of oncotherapy that radix aristolochiae heterophyllae phenanthrene lactone B lowers FoxM1 genes 李世龙 2018-08-17 — — CN disclosed
EP-0090516-B1 SUBSTITUTED HEXAHYDROPYRROLO(1,2-A)-QUINOLINE, HEXAHYDRO-1H-PYRIDO(1,2-A)-QUINOLINE, HEXAHYDROBENZO(3)INDENE AND OCTAHYDROPHENANTHRENE CNS AGENTS PFIZER INC. (US) 1988-07-06 — — EP disclosed
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