SCHEMBL10918652

SCHEMBL10918652

COc1c(C#N)oc2c3ccccc3n(C)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.41
EGFR P00533 1/20 0.39
SRC P12931 1/20 0.39
KDM4E B2RXH2 3/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GPR3 P46089 1/20 0.37
CYP11B2 P19099 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
FTO Q9C0B1 1/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36

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
SCHEMBL10654484 0.83 LMNA (0.41) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL10653805 0.74 PABPC1 (0.43) PABPC1EGFRKDM4EKMT2AALDH1A1
SCHEMBL10654409 0.73 PABPC1 (0.42) PABPC1EGFRSRCKDM4EMAPT
SCHEMBL10916358 0.72 PABPC1 (0.37) PABPC1KDM4EMAPTMEN1KMT2A
SCHEMBL10655784 0.71 PABPC1 (0.38) PABPC1KDM4EMAPTMEN1KMT2A
SCHEMBL10655975 0.70 KDM4E (0.45) PABPC1KDM4EMAPTMEN1KMT2A
SCHEMBL11269382 0.69 HPGD (0.39) EGFRSRCKDM4EMAPTMEN1
SCHEMBL10654396 0.69 ALDH1A1 (0.38) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL10654954 0.69 KDM4E (0.47) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL9754555 0.67 GPR3 (0.48) KDM4EMAPTALDH1A1HPGDHSD17B10

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
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