SCHEMBL1712451

SCHEMBL1712451

N[C@](CO)(C(=O)O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
CYP2D6 P10635 1/20 0.47
HIF1A Q16665 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KCNN4 O15554 3/20 0.42
MAPT P10636 1/20 0.42
GRM5 P41594 1/20 0.42
GRM1 Q13255 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 2/20 0.41
KIF11 P52732 3/20 0.39
HTT P42858 1/20 0.39
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP13 P45452 1/20 0.37

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
SCHEMBL1712450 1.00 CYP1A2 (0.47) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL1712531 1.00 CYP1A2 (0.47) CYP1A2KMT2AMEN1CYP2D6HIF1A
Hydrochloric Acid SCHEMBL8064648 0.98 CYP1A2 (0.46) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL10885482 0.85 MAPT (0.50) CYP1A2KMT2ACYP2D6HIF1ASMN1; SMN2
SCHEMBL11826573 0.83 CYP1A2 (0.44) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL1081535 0.83 CYP1A2 (0.47) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL2089245 0.81 CYP1A2 (0.70) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL305912 0.81 CYP1A2 (0.70) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL7617984 0.81 CYP1A2 (0.48) CYP1A2KMT2AMEN1CYP2D6HIF1A
SCHEMBL8783850 0.81 HIF1A (0.53) CYP1A2KMT2AMEN1CYP2D6HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344460-B1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AKASHI THERAPEUTICS INC (US) 2015-08-12 EP disclosed
US-8383608-B2 Imidazolidine compounds as androgen receptor modulators DART THERAPEUTICS LLC 2013-02-26 US disclosed
US-20120178718-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AKASHI THERAPEUTICS, INC. 2012-07-12 US disclosed
EP-2344460-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Galapagos N.V. (BE) 2011-07-20 EP disclosed
US-7968581-B2 Imidazolidine compounds as androgen receptor modulators GALAPAGOS NV (BE) 2011-06-28 US disclosed
US-20100113547-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AKASHI THERAPEUTICS, INC. 2010-05-06 US disclosed
WO-2010029119-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS GALAPAGOS NV (BE) 2010-03-18 WO disclosed
US-5959141-A 1-amino-2-hydroxycycloalkanecarboxylic acid derivatives SUNTORY LIMITED (JP) 1999-09-28 US disclosed
EP-0844992-A1 PROCESS FOR PRODUCING $g(b)-AMINO-$g(a)-HYDROXYCARBOXYLIC ACIDS AND DERIVATIVES THEREOF Degussa Aktiengesellschaft (DE) 1998-06-03 EP disclosed
WO-1997002236-A1 PROCESS FOR PRODUCING β-AMINO-α-HYDROXYCARBOXYLIC ACIDS AND DERIVATIVES THEREOF DEGUSSA AKTIENGESELLSCHAFT (DE) 1997-01-23 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 (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-20120178718-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, GNRHR CYP1A2 1325/4885KMT2A 2306/4885MEN1 1659/4885
US-20100113547-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, GNRHR CYP1A2 1056/4885KMT2A 2038/4885MEN1 1461/4885

“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.