SCHEMBL2929211

SCHEMBL2929211

CCOC(=O)c1cc(OCOCC[Si](C)(C)C)c2ccc(OCc3ccccc3)cc2c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
HSP90AA1 P07900 1/20 0.48
KMT2A Q03164 1/20 0.48
MAOB P27338 4/20 0.45
P2RY14 Q15391 1/20 0.45
DGAT1 O75907 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
PPARG P37231 1/20 0.43
NMT1 P30419 4/20 0.42
NMT2 O60551 1/20 0.42
LTB4R Q15722 1/20 0.42
LTB4R2 Q9NPC1 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL2927151 0.85 CA12 (0.40) MEN1KMT2AMAOB
SCHEMBL6041493 0.84 CDC25B (0.40) MEN1KMT2AGABRA1GABRG2GABRB3
SCHEMBL6206631 0.80 MAOB (0.51) MEN1HSP90AA1KMT2AMAOBP2RY14
SCHEMBL13057641 0.79 MEN1 (0.57) MEN1HSP90AA1KMT2AMAOBP2RY14
SCHEMBL2931013 0.78 MEN1 (0.56) MEN1HSP90AA1KMT2AMAOBP2RY14
SCHEMBL6041863 0.78 TDP1 (0.49) MAOBL3MBTL1
SCHEMBL13379254 0.77 MAOB (0.47) MEN1HSP90AA1KMT2AMAOB
SCHEMBL2931528 0.77 MEN1 (0.48) MEN1HSP90AA1KMT2AMAOBP2RY14
SCHEMBL2809626 0.76 MRGPRX4 (0.51) MEN1HSP90AA1KMT2AMAOB
SCHEMBL8180897 0.75 PPIA (0.44) MEN1HSP90AA1KMT2A

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-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD (CA) 2010-11-25 US disclosed
EP-2229373-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY Merck Frosst Canada Ltd. (CA) 2010-09-22 EP disclosed
WO-2009070873-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD. (CA) 2009-06-11 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-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY GPR119, GPR52, GPR35 MEN1 4181/4885HSP90AA1 1557/4885KMT2A 3592/4885

“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.