SCHEMBL9563117

SCHEMBL9563117

COc1ccc(C(=O)c2ccc([Si](C)(C)C)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.61
LMNA P02545 2/20 0.61
MAPT P10636 2/20 0.61
MAPK1 P28482 2/20 0.61
HPGD P15428 2/20 0.61
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
RAB9A P51151 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
ALDH1A1 P00352 2/20 0.56
GAA P10253 1/20 0.56
CES2 O00748 2/20 0.55
CES1 P23141 2/20 0.55
TUBB4A P04350 1/20 0.54
TUBB P07437 1/20 0.54
TUBA3C P0DPH7 1/20 0.54
TUBA1B P68363 1/20 0.54
TUBA4A P68366 1/20 0.54
TUBB4B P68371 1/20 0.54
TUBB3 Q13509 1/20 0.54

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
SCHEMBL11742914 0.87 TUBB4A (0.58) RXFP1LMNAMAPTMAPK1HPGD
SCHEMBL30080293 0.85 ALDH1A1 (0.52) LMNAMAPTMAPK1HPGDRAB9A
SCHEMBL9418310 0.85 RXFP1 (0.79) RXFP1LMNAMAPTMAPK1HPGD
SCHEMBL51509 0.85 RXFP1 (0.79) RXFP1LMNAMAPTMAPK1HPGD
SCHEMBL11746412 0.83 STS (0.59) MAPK1HPGDKMT2AMEN1RAB9A
SCHEMBL275937 0.83 CA1 (0.61) MAPTMAPK1KMT2AMEN1RAB9A
SCHEMBL11747541 0.83 STS (0.56) RXFP1LMNAMAPTMAPK1HPGD
SCHEMBL9563086 0.82 RXFP1 (0.54) RXFP1LMNAMAPTMAPK1HPGD
SCHEMBL11746478 0.82 CES2 (0.56) RXFP1LMNAMAPTMAPK1HPGD
SCHEMBL11746486 0.82 CES2 (0.61) RXFP1LMNAMAPTMAPK1HPGD

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
US-4042613-A PHOTOSENSITIZERS, POLYMERS DAI NIPPON PRINTING CO., LTD. (JA) 1977-08-16 US claimed
EP-0296878-B1 MODIFIED POLYSILOXANE-COATED SANITARY RUBBER ARTICLE AND PROCESS FOR ITS PRODUCTION DAIKYO GOMU SEIKO LTD. (JP) 1993-09-01 EP disclosed
US-5114794-A Coatings for medical equipment and drug containers for biological injections; adhesion; bonding strength DAIKYO GOMU SEIKO LTD. (JP) 1992-05-19 US disclosed
US-5110621-A Radiation with electrons, lasers, or ultraviolet rays to bond DAIKYO GOMU SEIKO LTD. (JP) 1992-05-05 US disclosed
US-4042613-A PHOTOSENSITIZERS, POLYMERS DAI NIPPON PRINTING CO., LTD. (JA) 1977-08-16 US disclosed