SCHEMBL3863940

SCHEMBL3863940

CCCC(=O)Nc1ccc2oc3c(c2c1)CCCC3

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.61
RXFP1 Q9HBX9 1/20 0.56
KMT2A Q03164 1/20 0.54
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TP53 P04637 2/20 0.53
NFKB1 P19838 3/20 0.52
NPC1 O15118 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL3864728 0.93 MAPT (0.57) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL3867012 0.93 MAPT (0.57) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL3865043 0.93 MAPT (0.57) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL3863034 0.92 MAPT (0.56) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL18328447 0.92 MAPT (0.56) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL3864736 0.92 MAPT (0.56) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL3862354 0.91 MAPT (0.62) MAPTRXFP1KMT2AALDH1A1SMN1; SMN2
SCHEMBL3867110 0.91 MAPT (0.55) MAPTRXFP1KMT2AALDH1A1KDM4E
SCHEMBL3863835 0.90 MAPT (0.61) MAPTRXFP1KMT2AALDH1A1SMN1; SMN2
SCHEMBL3863032 0.88 MAPT (0.57) MAPTRXFP1KMT2ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601856-B2 Benzofurans as potassium ion channel modulators WYETH (US) 2009-10-13 US claimed
US-20080027049-A1 Such as 2,2-Dimethyl-N-(6,7,8,9-tetrahydro-dibenzofuran-2-yl)-propionamide WYETH (US) 2008-01-31 US claimed
US-9751851-B2 Molecules and compositions that inhibit gram negative bacteria and their uses THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2017-09-05 US disclosed
US-7601856-B2 Benzofurans as potassium ion channel modulators WYETH (US) 2009-10-13 US disclosed
US-7601856-B2 Benzofurans as potassium ion channel modulators WYETH (US) 2009-10-13 US disclosed
US-7601856-B2 Benzofurans as potassium ion channel modulators WYETH (US) 2009-10-13 US disclosed
US-20080027049-A1 Such as 2,2-Dimethyl-N-(6,7,8,9-tetrahydro-dibenzofuran-2-yl)-propionamide WYETH (US) 2008-01-31 US disclosed
US-20080027049-A1 Such as 2,2-Dimethyl-N-(6,7,8,9-tetrahydro-dibenzofuran-2-yl)-propionamide WYETH (US) 2008-01-31 US disclosed
US-20080027049-A1 Such as 2,2-Dimethyl-N-(6,7,8,9-tetrahydro-dibenzofuran-2-yl)-propionamide WYETH (US) 2008-01-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080027049-A1 Such as 2,2-Dimethyl-N-(6,7,8,9-tetrahydro-dibenzofuran-2-yl)-propionamide KCNJ2, KCNJ5, KCNA5 MAPT 2740/4885RXFP1 2737/4885KMT2A 525/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.