SCHEMBL5386734

SCHEMBL5386734

NCC1(CS(=O)(=O)O)CCCC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
BLM P54132 2/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
TSHR P16473 1/20 0.47
CACNA2D1 P54289 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
APP P05067 1/20 0.31

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
SCHEMBL1333638 0.98 LMNA (0.50) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL5384819 0.98 LMNA (0.50) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL6880705 0.92 USP2 (0.41) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7249850 0.84 USP2 (0.33) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7254431 0.81 LMNA (0.31) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7248650 0.81 LMNA (0.31) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7255438 0.81 APP (0.32) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7174675 0.80 USP2 (0.37) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7423794 0.80 CYP1A2 (0.46) LMNABLMUSP2ALDH1A1CYP1A2
SCHEMBL7423791 0.80 CYP1A2 (0.46) LMNABLMUSP2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1475371-A1 1-SUBSTITUTED-1-AMINOMETHYL-CYCLOALKANE DERIVATIVES (= GABAPENTIN ANALOGUES), THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISORDERS Warner-Lambert Company LLC (US) 2004-11-10 EP claimed
US-20040097405-A1 Method of treating cartilage damage SCHRIER DENIS (US) 2004-05-20 US claimed
CN-1495160-A I-substituted-1-aminomethyl-cycloalkane derivative (gabapentin analogs), its preparation and application for curing neuropathy ��ʲ 2004-05-12 CN claimed
US-20040006073-A1 Method of treating attention deficit hyperactivity disorder DOOLEY DAVID JAMES (US) 2004-01-08 US claimed
US-20020072533-A1 Method of treating cartilage damage SCHRIER DENIS (US) 2002-06-13 US claimed
EP-1199072-A2 Method of treating cartilage damage WARNER-LAMBERT COMPANY (US) 2002-04-24 EP claimed
JP-2002508362-A 2002-03-19 JP claimed
CN-1279674-A 1-substituted-1-aminomethyl-cycloalkane derivatives (= gabapentin analogues), their preparation and their use in the treatment of neurological disorders WARNER LAMBERT CO (US) 2001-01-10 CN claimed
EP-1047678-A1 1-SUBSTITUTED-1-AMINOMETHYL-CYCLOALKANE DERIVATIVES (=GABAPENTIN ANALOGUES), THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISORDERS Warner-Lambert Company LLC (US) 2000-11-02 EP claimed
WO-1999031075-A1 1-SUBSTITUTED-1-AMINOMETHYL-CYCLOALKANE DERIVATIVES (=GABAPENTIN ANALOGUES), THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISORDERS WARNER-LAMBERT COMPANY (US) 1999-06-24 WO claimed
CN-101283995-A Different pharmaceutical uses alpha2delta ligands WARNER LAMBERT CO (US) 2008-10-15 CN disclosed
US-20070293570-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS WARNER-LAMBERT COMPANY (US) 2007-12-20 US disclosed
US-20070276039-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS WARNER-LAMBERT COMPANY LLC (US) 2007-11-29 US disclosed
US-20070213401-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS WARNER-LAMBERT COMPANY LLC (US) 2007-09-13 US disclosed
US-20070161707-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS WARNER-LAMBERT COMPANY LLC (US) 2007-07-12 US disclosed
EP-1199072-A2 Method of treating cartilage damage WARNER-LAMBERT COMPANY (US) 2002-04-24 EP disclosed
CN-1279674-A 1-substituted-1-aminomethyl-cycloalkane derivatives (= gabapentin analogues), their preparation and their use in the treatment of neurological disorders WARNER LAMBERT CO (US) 2001-01-10 CN disclosed
EP-0133318-B1 CYCLOALIPHATIC AMINOSULPHONIC-ACID DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL PREPARATIONS FOR COMBATING HEART AND VASCULAR DISEASES GÖDECKE AKTIENGESELLSCHAFT (DE) 1987-01-07 EP disclosed
US-4587263-A CARDIOVASCULAR DISORDERS WARNER-LAMBERT COMPANY (US) 1986-05-06 US disclosed
EP-0133318-A1 Cycloaliphatic aminosulphonic-acid derivatives, process for their production and pharmaceutical preparations for combating heart and vascular diseases GÖDECKE AKTIENGESELLSCHAFT (DE) 1985-02-20 EP 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 (7 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-20070213401-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS ADRA2A, ADRA1D, OPRD1 LMNA 2350/4885BLM 3962/4885USP2 4327/4885
US-20070293570-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS ADRA2A, ADRA1D, OPRD1 LMNA 2350/4885BLM 3962/4885USP2 4327/4885
US-20020072533-A1 Method of treating cartilage damage COL2A1, COL1A1, GABRB1 LMNA 406/4885BLM 2270/4885USP2 1071/4885
US-20070161707-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS ADRA2A, ADRA1D, OPRD1 LMNA 2350/4885BLM 3962/4885USP2 4327/4885
US-20070276039-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS ADRA2A, ADRA1D, OPRD1 LMNA 2350/4885BLM 3962/4885USP2 4327/4885
US-20040097405-A1 Method of treating cartilage damage COL2A1, COL1A1, GABRB1 LMNA 406/4885BLM 2270/4885USP2 1071/4885
US-20040006073-A1 Method of treating attention deficit hyperactivity disorder GABRB2, GABBR1, GABBR2 LMNA 4731/4885BLM 4687/4885USP2 2142/4885

“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.