SCHEMBL16210883

SCHEMBL16210883

CCN(CC)C(=O)c1c(NC(=O)c2ccco2)sc2c1CCCCC2

nearest known ligand 0.98

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.98
ALDH1A1 P00352 10/20 0.79
GAA P10253 2/20 0.79
HPGD P15428 10/20 0.72
MAPT P10636 7/20 0.72
KDM4E B2RXH2 7/20 0.72
HSD17B10 Q99714 4/20 0.72
USP2 O75604 2/20 0.72
NPSR1 Q6W5P4 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
ALOX15 P16050 2/20 0.72
MAPK1 P28482 1/20 0.72
PTGER2 P43116 1/20 0.72
L3MBTL1 Q9Y468 1/20 0.72
RAB9A P51151 3/20 0.72
SMN1; SMN2 Q16637 3/20 0.72
NPC1 O15118 3/20 0.72
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
LMNA P02545 1/20 0.72

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
SCHEMBL5449432 0.82 ALDH1A1 (1.00) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL5453296 0.82 FLT3 (1.00) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL8288728 0.80 ALDH1A1 (1.00) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL16211025 0.80 ALDH1A1 (0.72) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL8290734 0.79 HPGD (1.00) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL21067808 0.79 KIF11 (1.00) KIF11HPGDMAPTHSD17B10TDP1
SCHEMBL3916266 0.79 NPC1 (1.00) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL3913354 0.79 HPGD (0.78) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL8290847 0.79 NPC1 (0.80) KIF11ALDH1A1GAAHPGDMAPT
SCHEMBL3923759 0.76 KDM4E (0.73) ALDH1A1GAAHPGDMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140329674-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2014-11-06 US claimed
WO-2014179785-A1 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF INSCENT, INC. (US) 2014-11-06 WO claimed
US-9796676-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2017-10-24 US disclosed
US-9796676-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2017-10-24 US disclosed
US-9796676-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2017-10-24 US disclosed
US-20160251312-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2016-09-01 US disclosed
US-20160251312-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2016-09-01 US disclosed
US-20160251312-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2016-09-01 US disclosed
US-9357781-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2016-06-07 US disclosed
US-9357781-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2016-06-07 US disclosed
US-9357781-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2016-06-07 US disclosed
US-20140329674-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2014-11-06 US disclosed
WO-2014179785-A1 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF INSCENT, INC. (US) 2014-11-06 WO disclosed
WO-2014179785-A1 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF INSCENT, INC. (US) 2014-11-06 WO disclosed
US-20140329674-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2014-11-06 US disclosed
US-20140329674-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2014-11-06 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 (2 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-20160251312-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 KIF11 3460/4885ALDH1A1 2033/4885GAA 4796/4885
US-20140329674-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 KIF11 3460/4885ALDH1A1 2033/4885GAA 4796/4885

“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.