SCHEMBL2673103

SCHEMBL2673103

C=CCc1ccc(C=O)c(CC=C)c1CC=C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.33
GABRB2 P47870 2/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
SRD5A1 P18405 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL1918099 0.82 GABRA1 (0.43) GABRA1GABRB2POLBKDM4EMEN1
SCHEMBL2141001 0.82 GABRA1 (0.44) GABRA1GABRB2POLBKDM4ETDP1
SCHEMBL10879094 0.78 IMPDH2 (0.42) TDP1MEN1LMNATHRBBLM
SCHEMBL8518278 0.78 SRD5A1 (0.46) GABRA1GABRB2POLBKDM4EMEN1
SCHEMBL10904076 0.76 GABRA1 (0.39) GABRA1GABRB2POLBKDM4EMEN1
SCHEMBL9397812 0.75 GABRA1 (0.35) GABRA1GABRB2POLBSRD5A1
SCHEMBL28717434 0.74 SRC (0.35) GABRA1GABRB2POLBKDM4ETDP1
SCHEMBL6907532 0.74 GABRA1 (0.48) GABRA1GABRB2POLBKDM4EMEN1
SCHEMBL3799650 0.74 GABRA1 (0.41) GABRA1GABRB2POLBKDM4ETDP1
SCHEMBL7194028 0.73 ERN1 (0.42) GABRA1GABRB2POLBKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1264845-C 1,2,4,5-pyromellitic anhydride preparation NIPPON CATALYTIC CHEM IND (JP) 2006-07-19 CN claimed
US-20060148900-A1 Method for treating a mammal by administration of a compound having the ability to release CO, compounds having the ability to release CO and pharmaceutical compositions thereof ALFAMA - INVESTIGACAO E DESENVOLVIMENTO DE PRODUTOS FARMACEUTICOS LDA (PT) 2006-07-06 US claimed
CN-1177790-C Method for producing 2,4,5-trialkyl-benzaldehyde 株式会社日本触媒 2004-12-01 CN claimed
CN-1159279-C Method for preparing 1,2,4,5-pyromellitic anhydride ��ʽ�����ձ���ý 2004-07-28 CN claimed
US-6699999-B2 Process for producing pyromellitic anhydride NIPPON SHOKUBAI CO., LTD. (JP) 2004-03-02 US claimed
CN-1406941-A 1,2,4,5-pyromellitic anhydride preparation NIPPON CATALYTIC CHEM IND (JP) 2003-04-02 CN claimed
US-20030032816-A1 Process for producing pyromellitic anhydride NIPPON SHOKUBAI CO., LTD. 2003-02-13 US claimed
CN-1349992-A Method for preparing 1,2,4,5-pyromellitic anhydride NIPPON CATALYTIC CHEM IND (JP) 2002-05-22 CN claimed
CN-1345715-A Method for producing 2,4,5-trialkyl-benzaldehyde NIPPON CATALYTIC CHEM IND (JP) 2002-04-24 CN claimed
CN-103657631-A Catalyst and method for producing carboxylic acid and/or carboxylic anhydride in the presence of the catalyst MITSUBISHI GAS CHEMICAL CO 2014-03-26 CN disclosed
CN-101632925-B Catalyst and process for producing carboxylic acid and/or carboxylic acid anhydride using the same MITSUBISHI GAS CHEMICAL CO 2014-02-26 CN disclosed
US-8173630-B2 Multipodal tethers for high-density attachment of redox-active moieties to substrates THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-08 US disclosed
CN-101632925-A Catalyst and process for producing carboxylic acid and/or carboxylic acid anhydride using the same MITSUBISHI GAS CHEMICAL CO 2010-01-27 CN disclosed
CN-100443456-C High purity 3,4-dimethyl benzaldehyde preparation method UNIV JIANGSU POLYTECHNIC (CN) 2008-12-17 CN disclosed
CN-1345715-A Method for producing 2,4,5-trialkyl-benzaldehyde NIPPON CATALYTIC CHEM IND (JP) 2002-04-24 CN disclosed
EP-1193238-A1 Process for producing 2,4,5-trialkylbenzaldehydes Nippon Shokubai Co., Ltd. (JP) 2002-04-03 EP disclosed
CN-1273230-A Method for preparing dialkyl and trialkyl substituted benzaldehyde MILLIKEN CO (US) 2000-11-15 CN disclosed
US-4598157-A Method for the manufacture of pyromellitic acid dianhydride CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) 1986-07-01 US disclosed
EP-0064690-B1 PROCESS FOR THE PREPARATION OF SUBSTITUTED BENZALDEHYDES BAYER AG (DE) 1985-03-13 EP disclosed
EP-0064690-A1 Process for the preparation of substituted benzaldehydes BAYER AG (DE) 1982-11-17 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 (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-20060148900-A1 Method for treating a mammal by administration of a compound having the ability to release CO, compounds having the ability to release CO and pharmaceutical compositions thereof TNF, PTGS1, COX15 GABRA1 3313/4885GABRB2 3704/4885POLB 3415/4885

“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.