SCHEMBL293472

SCHEMBL293472

[CH2]CCCCC(=O)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.57
RAB9A P51151 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
LMNA P02545 2/20 0.49
TSHR P16473 2/20 0.49
POLB P06746 2/20 0.49
USP2 O75604 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ALDH1A1 P00352 2/20 0.47
FKBP1A P62942 1/20 0.47
ATM Q13315 1/20 0.47
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44

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
SCHEMBL7557900 0.98 GLA (0.56) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL7555206 0.98 GLA (0.56) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL7557661 0.98 GLA (0.56) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL7551563 0.98 GLA (0.56) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL294490 0.98 GLA (0.56) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL294529 0.94 GLA (0.59) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL9415751 0.90 GLA (0.67) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL7694058 0.88 GLA (0.65) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL295077 0.86 L3MBTL1 (0.55) GLARAB9AL3MBTL1LMNATSHR
SCHEMBL5452859 0.82 GLA (0.59) GLARAB9AL3MBTL1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004056353-A2 DEVICE AND METHOD FOR DELIVERING MMP INHIBITORS NOVARTIS AG (CH) 2004-07-08 WO claimed
US-20140031334-A1 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-01-30 US disclosed
US-8598162-B2 Derivatives of 4-piperazin-1-yl-4-benzo[B]thiophene suitable for the treatment of CNS disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-12-03 US disclosed
EP-1389611-B1 20-HYDROXYEICOSATETRAENOIC ACID PRODUCTION INHIBITORS TAISHO PHARMACEUTICAL CO LTD (JP) 2012-06-27 EP disclosed
EP-2287161-B1 Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders OTSUKA PHARMA CO LTD (JP) 2012-05-09 EP disclosed
EP-2287162-B1 Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders OTSUKA PHARMA CO LTD (JP) 2012-05-09 EP disclosed
EP-2284169-B1 Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders OTSUKA PHARMA CO LTD (JP) 2012-03-14 EP disclosed
US-20120028920-A1 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. 2012-02-02 US disclosed
EP-1919907-B9 HETEROCYCLIC COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-01-18 EP disclosed
US-8071600-B2 Derivatives of 4-piperazin-1-yl-4-benzo[B]thiophene suitable for the treatment of CNS disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-12-06 US disclosed
WO-2003075959-A1 MATRIX METALLOPROTEINASE INHIBITORS IN COMBINATION WITH HYPOTHERMIA AND/OR RADIOTHERAPY FOR THE TREATMENT OF CANCER NOVARTIS AG (CH) 2003-09-18 WO disclosed
US-6500983-B2 FOR THERAPY OF DISEASES OR CONDITIONS MEDIATED BY OVER-PRODUCTION OF OR OVER-RESPONSIVENESS TO TUMOR NECROSIS FACTOR (TNF) NOVARTIS AG (CH) 2002-12-31 US disclosed
EP-0929517-B1 HYDROXAMIC ACID DERIVATIVES NOVARTIS AG (CH) 2002-06-12 EP disclosed
US-20020038045-A1 Hydroxamic acid derivatives NOVARTIS AG (CH) 2002-03-28 US disclosed
EP-0929517-A1 HYDROXAMIC ACID DERIVATIVES Novartis AG (CH) 1999-07-21 EP disclosed
WO-1998014424-A1 HYDROXAMIC ACID DERIVATIVES NOVARTIS AG (CH) 1998-04-09 WO disclosed
CN-1114834-A antidiabetic agent OTSUKA PHARMA CO LTD (JP) 1996-01-10 CN disclosed
EP-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed
EP-0392317-A2 Benzimidazoles, drugs containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1990-10-17 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 (3 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-20120028920-A1 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS GRIN2C, GRIN2B, PMP22 GLA 4312/4885RAB9A 1250/4885L3MBTL1 1941/4885
US-20140031334-A1 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS GRIN2C, GRIN2B, PMP22 GLA 4312/4885RAB9A 1250/4885L3MBTL1 1941/4885
US-20020038045-A1 Hydroxamic acid derivatives TNF, HCAR2, HCAR1 GLA 288/4885RAB9A 3650/4885L3MBTL1 4396/4885

“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.