SCHEMBL6499707

SCHEMBL6499707

CCCCCC(=O)Nc1cnc2cc(C)ccc2c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
DEGS1 O15121 1/20 0.46
EP300 Q09472 1/20 0.45
HDAC3 O15379 2/20 0.45
HDAC4 P56524 2/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC7 Q8WUI4 2/20 0.45
HDAC2 Q92769 2/20 0.45
HDAC10 Q969S8 2/20 0.45
HDAC11 Q96DB2 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC9 Q9UKV0 2/20 0.45
HDAC5 Q9UQL6 2/20 0.45
GLA P06280 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPK1 P28482 2/20 0.45
KDM4E B2RXH2 2/20 0.45

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
SCHEMBL6489167 0.87 GLA (0.54) GAAL3MBTL1DEGS1EP300GLA
SCHEMBL6500635 0.84 EP300 (0.57) GAAL3MBTL1DEGS1EP300GLA
SCHEMBL27459501 0.83 MEN1 (0.45) GAAL3MBTL1TDP1ALDH1A1MAPK1
Water SCHEMBL5769374 0.81 MEN1 (0.44) GAAL3MBTL1TDP1ALDH1A1MAPK1
Water SCHEMBL5769377 0.81 MEN1 (0.44) GAAL3MBTL1TDP1ALDH1A1MAPK1
SCHEMBL6493124 0.80 KDR (0.53) GAAL3MBTL1TDP1
SCHEMBL5766643 0.79 POLB (0.56) GAAL3MBTL1GLAALDH1A1MAPK1
SCHEMBL5763717 0.79 NPC1 (0.49) GAAALDH1A1MAPK1KDM4ENPC1
SCHEMBL5146626 0.79 GSK3B (0.49) GAAALDH1A1MAPK1KDM4EHPGD
SCHEMBL5767044 0.77 NPC1 (0.50) ALDH1A1TSHRNPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908932-B2 Cancer therapy ICONIX PHARMACEUTICALS, INC. (US) 2005-06-21 US disclosed
US-20030149074-A1 Modulators of phosphoinositide 3-kinase ENTELOS HOLDING CORP. 2003-08-07 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-20030149074-A1 Modulators of phosphoinositide 3-kinase PIK3R1, PIK3R3, PIK3R4 GAA 3724/4885L3MBTL1 1422/4885TDP1 2263/4885

“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.