SCHEMBL3941900

SCHEMBL3941900

CC(C)Oc1ccc(NC(=O)c2cc(-c3ccc(OCCCC(=O)O)cc3)on2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
SMPD1 P17405 2/20 0.52
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
HSD17B10 Q99714 4/20 0.49
ATM Q13315 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HPGD P15428 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
ALDH1A1 P00352 1/20 0.48
ACR P10323 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
RORC P51449 1/20 0.47

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
SCHEMBL3933200 0.93 MAPT (0.52) MAPTSMPD1MEN1KMT2AHSD17B10
SCHEMBL3933197 0.89 MAPT (0.52) MAPTSMPD1MEN1KMT2AHSD17B10
SCHEMBL3933205 0.88 MEN1 (0.48) MAPTMEN1KMT2AHSD17B10ATM
SCHEMBL3933044 0.85 MAP4K4 (0.61) MAPTSMPD1MEN1KMT2AHSD17B10
SCHEMBL3933039 0.85 MAP4K4 (0.61) MAPTSMPD1MEN1KMT2AHSD17B10
SCHEMBL13902144 0.84 RORC (0.57) MAPTMEN1KMT2AHSD17B10ATM
SCHEMBL3933802 0.83 HSD17B10 (0.69) MAPTMEN1KMT2AHSD17B10ATM
SCHEMBL3942313 0.81 MAPT (0.54) MAPTMEN1KMT2AHSD17B10ATM
SCHEMBL13962585 0.80 MAPT (0.56) MAPTSMPD1MEN1KMT2AHSD17B10
SCHEMBL13901888 0.79 MAPT (0.52) MAPTHSD17B10KDM4EHPGDNPC1

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-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 US disclosed
US-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 US disclosed
US-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 US disclosed
WO-2009011850-A2 NOVEL THERAPEUTIC COMPOUNDS ABBOTT LABORATORIES (US) 2009-01-22 WO disclosed
WO-2009011850-A2 NOVEL THERAPEUTIC COMPOUNDS ABBOTT LABORATORIES (US) 2009-01-22 WO 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-20090069288-A1 Novel therapeutic compounds MAP3K20, RPS6KB1, MAP3K1 MAPT 3755/4885SMPD1 734/4885MEN1 3233/4885

“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.