SCHEMBL10885404

SCHEMBL10885404

CCOC(=O)/C(C)=C/c1ccc(C=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.57
MEN1 O00255 8/20 0.57
KMT2A Q03164 8/20 0.57
LMNA P02545 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
MAPK1 P28482 2/20 0.57
S1PR4 O95977 1/20 0.57
S1PR1 P21453 1/20 0.57
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
ALDH1A1 P00352 10/20 0.45
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HSP90AA1 P07900 2/20 0.45
HTT P42858 2/20 0.45
MITF O75030 1/20 0.45
HPGD P15428 1/20 0.44
NR1H4 Q96RI1 1/20 0.43
PTGS2 P35354 1/20 0.41

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
SCHEMBL10564181 1.00 MAPT (0.57) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL3609468 0.88 MAPT (0.58) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL3609471 0.88 MAPT (0.58) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL321922 0.86 MAPT (0.57) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL7030290 0.86 KMT2A (0.76) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL12035802 0.86 KMT2A (0.57) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL14358911 0.86 MAPT (0.57) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL5617201 0.86 KMT2A (0.57) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL7651650 0.86 KMT2A (0.76) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL321923 0.86 MAPT (0.57) MAPTMEN1KMT2ALMNANPSR1

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
EP-0107618-B1 N-SUBSTITUTED-2-(1-IMIDAZOLYL)-INDOLES CIBA-GEIGY AG (CH) 1986-07-16 EP disclosed
US-4539410-A THROMBOXANE SYNEHETASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1985-09-03 US disclosed
US-4511573-A THROMBOXANE SYNTHETASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1985-04-16 US disclosed
US-4478842-A THROMBOXANE SYNTHETASE INHIBITORS CIBA-GEIGY CORPORATION (US) 1984-10-23 US disclosed
EP-0107618-A1 N-substituted-2-(1-imidazolyl)-indoles CIBA-GEIGY AG (CH) 1984-05-02 EP disclosed
US-4335054-A Process for the preparation of alkenylbenzenecarboxylic acid derivatives and alkenylnaphthalenecarboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1982-06-15 US disclosed