SCHEMBL2503383

SCHEMBL2503383

C/C=C/C(=O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.68
NR4A2 P43354 6/20 0.67
SMPD1 P17405 1/20 0.60
SRD5A2 P31213 1/20 0.59
PTPN1 P18031 1/20 0.58
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
PKM P14618 1/20 0.56
LMNA P02545 1/20 0.55
THRB P10828 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
GPR52 Q9Y2T5 1/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
NR4A1 P22736 1/20 0.53
NR4A3 Q92570 1/20 0.53
NR1H4 Q96RI1 1/20 0.53
MRGPRX4 Q96LA9 1/20 0.52

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
SCHEMBL2503385 1.00 MAOB (0.68) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL11561702 0.84 NR4A2 (0.72) MAOBNR4A2SMPD1SRD5A2PTPN1
Water SCHEMBL10958624 0.83 NR4A2 (0.70) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL27488704 0.83 NR4A2 (0.70) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL68983 0.81 MAOB (1.00) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL6950489 0.81 NR4A2 (0.67) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL6950492 0.81 NR4A2 (0.67) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL27666250 0.81 NR4A2 (0.67) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL30207018 0.81 NR4A2 (1.00) MAOBNR4A2SMPD1SRD5A2PTPN1
SCHEMBL7908051 0.81 SRD5A2 (0.85) MAOBNR4A2SMPD1SRD5A2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
WO-2009048527-A1 SUBSTITUTED BIPHENYL GPR40 MODULATORS AMGEN INC. (US) 2009-04-16 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-20090137561-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 MAOB 2736/4885NR4A2 43/4885SMPD1 1522/4885

“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.