SCHEMBL10274486

SCHEMBL10274486

CC1CN(C(=O)c2ccccc2)C1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.75
ATG4B Q9Y4P1 1/20 0.75
ACHE P22303 1/20 0.68
HPGD P15428 2/20 0.63
ALDH1A1 P00352 2/20 0.63
CHRNB2 P17787 2/20 0.61
CHRNB4 P30926 2/20 0.61
CHRNA3 P32297 2/20 0.61
CHRNA7 P36544 2/20 0.61
CHRNA4 P43681 2/20 0.61
GAA P10253 1/20 0.61
HSD17B10 Q99714 1/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
KDM4E B2RXH2 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SIGMAR1 Q99720 1/20 0.52
BLM P54132 1/20 0.51
GRM5 P41594 1/20 0.51
RBP4 P02753 1/20 0.51

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
SCHEMBL14236778 0.92 PLA2G1B (0.87) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL15958971 0.89 PLA2G1B (0.67) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL15154927 0.86 PLA2G1B (1.00) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL18166097 0.85 ACHE (0.81) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL433828 0.85 ACHE (0.81) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL25946040 0.85 ACHE (0.81) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL8763794 0.83 ALDH1A1 (0.88) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL14304554 0.83 CHRNB2 (0.60) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL10293597 0.83 CHRNB2 (0.60) PLA2G1BATG4BACHEHPGDALDH1A1
SCHEMBL29921739 0.83 ALDH1A1 (0.88) PLA2G1BATG4BACHEHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3660023-B1 THIENOPYRIMIDINEDIONE COMPOUNDS AS ACC INHIBITORS AND USE THEREOF NANJING SANHOME PHARMACEUTICAL CO LTD (CN) 2023-03-08 EP disclosed
WO-2019020041-A1 COMPOUND AS ACC INHIBITOR AND USE THEREOF 南京圣和药业股份有限公司 2019-01-31 WO disclosed
EP-2421823-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-01-14 EP disclosed
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-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-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
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
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
EP-2287161-A1 Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of cns disorders Otsuka Pharmaceutical Co., Limited (JP) 2011-02-23 EP disclosed
EP-2287162-A1 Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of cns disorders Otsuka Pharmaceutical Co., Ltd. (JP) 2011-02-23 EP disclosed
EP-2284169-A1 Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders Otsuka Pharmaceutical Co., Limited (JP) 2011-02-16 EP disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 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-20120028920-A1 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS GRIN2C, GRIN2B, PMP22 PLA2G1B 3421/4885ATG4B 3243/4885ACHE 844/4885
US-20140031334-A1 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZO[B]THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS GRIN2C, GRIN2B, PMP22 PLA2G1B 3421/4885ATG4B 3243/4885ACHE 844/4885

“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.