SCHEMBL5720616

SCHEMBL5720616

CCOC(=O)C(C#N)=C1C=C(C)OC(C)=C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.51
▸ MAPT P10636 5/20 0.51
▸ KDM4E B2RXH2 4/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ ALDH1A1 P00352 10/20 0.47
▸ TSHR P16473 3/20 0.47
▸ ATM Q13315 1/20 0.47
▸ MAPK1 P28482 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ HPGD P15428 3/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ GAA P10253 1/20 0.38

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
SCHEMBL14447750 0.85 TSHR (0.40) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL14448772 0.82 ALDH1A1 (0.41) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL14447748 0.82 TSHR (0.36) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL14448217 0.81 MAPT (0.51) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL4338452 0.78 CYP3A4 (0.39) MAPTKDM4EALDH1A1TSHRATM
SCHEMBL13223786 0.76 MAPT (0.47) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL14448679 0.74 MAPT (0.44) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL14447733 0.74 MAPT (0.44) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL14448683 0.73 MEN1 (0.41) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL10655681 0.72 MAPK1 (0.46) KMT2AMAPTKDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474098-B1 SUNSCREEN COMPOSITIONS AS WELL AS DIHYDROPYRIDINES AND DIHYDROPYRANES DSM IP ASSETS BV (NL) 2006-08-02 — — EP claimed
US-20100294368-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2010-11-25 — — US disclosed
US-5719690-A Photorefractive glass article INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1998-02-17 — — US disclosed
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