SCHEMBL10654464

SCHEMBL10654464

CCOc1c(C(=O)Nc2nnn[nH]2)oc2c3ccccc3n(-c3ccccc3)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.35
KMT2A Q03164 2/20 0.34
PPARG P37231 1/20 0.33
ALDH1A1 P00352 6/20 0.33
MAPK8 P45983 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
MAPT P10636 3/20 0.32
TSHR P16473 2/20 0.32
POLB P06746 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.32
BRCA1 P38398 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HPGD P15428 3/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPK1 P28482 1/20 0.32
CYP1A2 P05177 1/20 0.31
GLA P06280 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL10655883 0.90 PKM (0.34) RECQLKMT2AALDH1A1MAPK8SMN1; SMN2
SCHEMBL10654966 0.89 KMT2A (0.40) KMT2AALDH1A1SMN1; SMN2MAPTNPSR1
SCHEMBL10652305 0.81 KDM4E (0.41) KMT2AALDH1A1MAPTMEN1HSD17B10
SCHEMBL10654421 0.80 ALDH1A1 (0.44) RECQLKMT2APPARGALDH1A1MAPK8
SCHEMBL10652918 0.79 MAPK8 (0.43) RECQLKMT2APPARGALDH1A1MAPK8
SCHEMBL10371010 0.78 ALDH1A1 (0.38) KMT2AALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL10654943 0.78 KDM4E (0.36) KMT2AALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL10654412 0.78 RECQL (0.41) RECQLKMT2APPARGALDH1A1MAPK8
SCHEMBL10652379 0.78 PPARG (0.33) RECQLKMT2APPARGALDH1A1MAPK8
SCHEMBL9535836 0.74 MEN1 (0.44) KMT2APPARGALDH1A1MAPK8SMN1; SMN2

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-4596814-A Antiallergens WARNER-LAMBERT COMPANY (US) 1986-06-24 US claimed
EP-0092380-B1 ANTIALLERGIC 4H-FURO(3,2-B)INDOLES AND THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1988-01-20 EP disclosed
US-4596814-A Antiallergens WARNER-LAMBERT COMPANY (US) 1986-06-24 US disclosed
US-4503236-A Antiallergic 4Hfuro[3,2-b]indoles WARNER-LAMBERT COMPANY (US) 1985-03-05 US disclosed
EP-0092380-A2 Antiallergic 4H-furo(3,2-b)indoles and their production WARNER-LAMBERT COMPANY (US) 1983-10-26 EP disclosed