SCHEMBL15067792

SCHEMBL15067792

COc1ccc(C(=O)c2ccc(C#CCN(C)C)nc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.51
▸ VNN1 O95497 9/20 0.47
▸ ACHE P22303 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ CYP19A1 P11511 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL17676104 0.72 LMNA (0.35) RXFP1LMNAMAPTRAB9AALDH1A1
SCHEMBL15067149 0.71 RXFP1 (0.52) RXFP1VNN1ACHELMNANPSR1
SCHEMBL27944064 0.70 RXFP1 (0.58) RXFP1VNN1LMNANPSR1HPGD
SCHEMBL15067437 0.69 RXFP1 (0.65) RXFP1VNN1LMNANPSR1HPGD
SCHEMBL51509 0.69 RXFP1 (0.79) RXFP1LMNANPSR1HPGDMEN1
SCHEMBL9418310 0.69 RXFP1 (0.79) RXFP1LMNANPSR1HPGDMEN1
SCHEMBL7081483 0.68 APP (0.50) CA1CA2
SCHEMBL24233106 0.66 MAPK1 (0.53) MAPTMAPK1RAB9AKMT2ACA1
Ethyne SCHEMBL8195983 0.66 RXFP1 (0.73) RXFP1LMNANPSR1HPGDMEN1
SCHEMBL19409872 0.65 MAPT (0.73) RXFP1ACHELMNANPSR1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9309211-B2 Arylalkene derivatives and use thereof as selective estrogen receptor modulators CENTAURUS BIOPHARMA CO., LTD. (CN) 2016-04-12 — — US disclosed
US-9309211-B2 Arylalkene derivatives and use thereof as selective estrogen receptor modulators CENTAURUS BIOPHARMA CO., LTD. (CN) 2016-04-12 — — US disclosed
US-9309211-B2 Arylalkene derivatives and use thereof as selective estrogen receptor modulators CENTAURUS BIOPHARMA CO., LTD. (CN) 2016-04-12 — — US disclosed
EP-2797889-A1 NOVEL ARYLALKENE DERIVATIVES AND USE THEREOF AS SELECTIVE ESTROGEN RECEPTOR MODULATORS Centaurus Biopharma Co., Ltd. (CN) 2014-11-05 — — EP disclosed
WO-2013097773-A1 NOVEL ARYLALKENE DERIVATIVES AND USE THEREOF AS SELECTIVE ESTROGEN RECEPTOR MODULATORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2013-07-04 — — WO disclosed
WO-2013097773-A1 NOVEL ARYLALKENE DERIVATIVES AND USE THEREOF AS SELECTIVE ESTROGEN RECEPTOR MODULATORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2013-07-04 — — WO disclosed
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