SCHEMBL8104632

SCHEMBL8104632

C/C(=C\C(=O)c1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MAPK1 P28482 2/20 0.52
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
AKR1C3 P42330 1/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC3 O15379 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
MAPT P10636 5/20 0.50
RAB9A P51151 4/20 0.50
NPC1 O15118 3/20 0.50
GAA P10253 2/20 0.50
THRB P10828 1/20 0.50
AKT1 P31749 1/20 0.50
CYP2C9 P11712 2/20 0.49
RECQL P46063 2/20 0.47
CA12 O43570 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
SCHEMBL2791186 1.00 NFE2L2 (0.59) NFE2L2MEN1KMT2AMAPK1ALDH1A1
SCHEMBL11710569 0.88 SMN1; SMN2 (0.57) NFE2L2MEN1KMT2AALDH1A1AKR1C3
SCHEMBL5566136 0.84 AKR1C3 (0.54) NFE2L2MEN1KMT2AMAPK1ALDH1A1
SCHEMBL14990811 0.83 ALDH1A1 (0.57) MEN1KMT2AALDH1A1TDP1MAPT
SCHEMBL703413 0.83 ALDH1A1 (0.57) MEN1KMT2AALDH1A1TDP1MAPT
SCHEMBL3794069 0.83 NFE2L2 (0.55) NFE2L2MEN1KMT2AMAPK1ALDH1A1
SCHEMBL3794074 0.83 NFE2L2 (0.55) NFE2L2MEN1KMT2AMAPK1ALDH1A1
SCHEMBL12038091 0.83 NFE2L2 (0.59) NFE2L2MEN1KMT2AMAPK1ALDH1A1
SCHEMBL10984963 0.82 NFE2L2 (0.64) NFE2L2MEN1KMT2AMAPK1ALDH1A1
SCHEMBL566675 0.82 NFE2L2 (0.64) NFE2L2MEN1KMT2AMAPK1ALDH1A1

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
US-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US disclosed
CN-1139571-C Process for preparing homophenylalanin derivs ��Ԩ��ѧ��ҵ��ʽ���� 2004-02-25 CN disclosed
CN-1321636-A Process for preparing homophenylalanin derivs KANEGAFUCHI CHEMICAL IND (JP) 2001-11-14 CN disclosed
US-6126855-A Reaction products of lyotropic liquid crystal salt complexes ELLIOTT STANLEY B (US) 2000-10-03 US disclosed
CN-1217710-A Gamma-oxo-homophenylalanine derivative and process for producing homophenylalanine derivative by reducing the same KANEKA CHEMICAL IND CO LTD (JP) 1999-05-26 CN disclosed
US-5833877-A DIAGMAGNETIC COMPLEX; SUPERCONDUCTORS ELLIOTT STANLEY B (US) 1998-11-10 US disclosed
WO-1998001511-A1 REACTION PROCUCTS OF LYOTROPIC LIQUID CRYSTAL SALT COMPLEXES ELLIOTT STANLEY B (US) 1998-01-15 WO disclosed
US-5595683-A COMPLEX OF METAL SALT OF BENZOYLPROPIONIC ACID, LATTICE MODIFIER, CYCLIZATION, HUMIDITY SENSORS ELLIOTT STANLEY B (US) 1997-01-21 US disclosed
US-5443753-A Reaction products of lyotropic liquid crystal salt complexes ELLIOTT STANLEY B (US) 1995-08-22 US disclosed
US-5354499-A Reaction products of lyotropic liquid crystal salt complexes ELLIOTT STANLEY B (US) 1994-10-11 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 NFE2L2 4825/4885MEN1 4777/4885KMT2A 2536/4885

“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.