SCHEMBL873444

SCHEMBL873444

c1ccc(C[C@H]2CO2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GRM2 Q14416 1/20 0.46
TAAR1 Q96RJ0 2/20 0.46
GBA1 P04062 1/20 0.43
TSHR P16473 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
SCHEMBL51254 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3TDP1MEN1
SCHEMBL2186411 1.00 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3TDP1MEN1
Methane SCHEMBL28820455 0.98 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3TDP1MEN1
Dimethylamine SCHEMBL28875130 0.91 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3TDP1MEN1
SCHEMBL6664494 0.88 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3TDP1MEN1
SCHEMBL170098 0.88 TDP1 (0.53) SLC6A2SLC6A4SLC6A3TDP1MEN1
SCHEMBL131333 0.87 TDP1 (0.38) SLC6A2SLC6A4SLC6A3TDP1MEN1
SCHEMBL7765145 0.87 MGLL (0.48) TDP1MEN1KMT2ATAAR1
SCHEMBL30300699 0.87 MGLL (0.48) TDP1MEN1KMT2ATAAR1
SCHEMBL1957441 0.85 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3MEN1KMT2A

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 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110564755-B Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2021-01-12 CN claimed
CN-110564755-A Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2019-12-13 CN claimed
CN-110564755-B Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2021-01-12 CN disclosed
CN-110564755-B Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2021-01-12 CN disclosed
CN-110564755-B Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2021-01-12 CN disclosed
CN-110564755-A Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2019-12-13 CN disclosed
CN-110564755-A Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2019-12-13 CN disclosed
CN-110564755-A Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis 河南农业大学 2019-12-13 CN disclosed
US-20190010129-A1 Amide derivatives as lysophosphatidic acid receptor antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED 2019-01-10 US disclosed
US-10100018-B2 Amide derivatives as lysophosphatidic acid receptor antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-10-16 US disclosed
US-9624200-B2 Therapeutic piperazines DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2017-04-18 US disclosed
US-20050222464-A1 Preparation of P-chirogenic phospholanes and their use in asymmetric synthesis HOGE GARRETT S II 2005-10-06 US disclosed
EP-1341799-B1 P-CHIRALE BISPHOSPHOLANE LIGANDS, THEIR TRANSITION METAL COMPLEXES WARNER LAMBERT CO (US) 2005-03-16 EP disclosed
US-20040215027-A1 Synthesis of P-chiral bisphospholane ligands and their transition metal complexes for use as asymmetric hydrogenation catalysts HOGE GARRETT STEWART 2004-10-28 US disclosed
US-6750171-B2 IMPROVE ENANTIOSELECTIVITY IN ASYMMETRIC REACTIONS WARNER-LAMBERT COMPANY LLC 2004-06-15 US disclosed
US-20030236433-A1 Synthesis of P-chiral bisphospholane ligands and their transition metal complexes for use as asymmetric hydrogenation catalysts HOGE GARRETT STEWART (US) 2003-12-25 US disclosed
EP-1341799-A1 P-CHIRALE BISPHOSPHOLANE LIGANDS, THEIR TRANSITION METAL COMPLEXES Warner-Lambert Company LLC (US) 2003-09-10 EP disclosed
US-6605745-B2 Locates chirality closer to the metal center than known metal phospholane complexes; provide high enantiomeric excesses of formed compounds HOGE II GARRETT STEWART (US) 2003-08-12 US disclosed
US-20020087017-A1 Synthesis of P-chiral bisphospholane ligands and their transition metal complexes for use as asymmetric hydrogenation catalysts HOGE GARRETT STEWART (US) 2002-07-04 US disclosed
WO-2002048161-A1 P-CHIRALE BISPHOSPHOLANE LIGANDS, THEIR TRANSITION METAL COMPLEXES WARNER-LAMBERT COMPANY LLC (US) 2002-06-20 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 (6 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-20040215027-A1 Synthesis of P-chiral bisphospholane ligands and their transition metal complexes for use as asymmetric hydrogenation catalysts PHOSPHO1, BPGM, PHPT1 SLC6A2 2995/4885SLC6A4 2097/4885SLC6A3 1725/4885
US-10100018-B2 Amide derivatives as lysophosphatidic acid receptor antagonists LPAR1, LPAR2, LPAR3 SLC6A2 3198/4885SLC6A4 3586/4885SLC6A3 3701/4885
US-20190010129-A1 Amide derivatives as lysophosphatidic acid receptor antagonists LPAR1, LPAR2, LPAR3 SLC6A2 3369/4885SLC6A4 3681/4885SLC6A3 3965/4885
US-20050222464-A1 Preparation of P-chirogenic phospholanes and their use in asymmetric synthesis PYGB, PNKP, GAP43 SLC6A2 2425/4885SLC6A4 2084/4885SLC6A3 2650/4885
US-20030236433-A1 Synthesis of P-chiral bisphospholane ligands and their transition metal complexes for use as asymmetric hydrogenation catalysts PHOSPHO1, BPGM, PHPT1 SLC6A2 2995/4885SLC6A4 2097/4885SLC6A3 1725/4885
US-20020087017-A1 Synthesis of P-chiral bisphospholane ligands and their transition metal complexes for use as asymmetric hydrogenation catalysts PHOSPHO1, BPGM, PHPT1 SLC6A2 2995/4885SLC6A4 2097/4885SLC6A3 1725/4885

“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.