SCHEMBL3539236

SCHEMBL3539236

CCC(O)CNC1CCCCC1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.76
SMN1; SMN2 Q16637 2/20 0.59
HTT P42858 1/20 0.59
SLC2A1 P11166 1/20 0.46
ANPEP P15144 2/20 0.46
ERAP2 Q6P179 2/20 0.46
KMT2A Q03164 2/20 0.43
ADRB2 P07550 1/20 0.43
SHBG P04278 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
EPHX1 P07099 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL18124380 0.98 KDM4E (0.72) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL18124403 0.94 KDM4E (0.65) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL18124374 0.89
SCHEMBL27980382 0.87 KDM4E (1.00) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL9473718 0.84 KDM4E (0.70) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL18124388 0.82 KDM4E (0.67) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL3535515 0.81 KDM4E (0.79) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL16822348 0.81 KDM4E (0.79) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL11425371 0.80 KDM4E (0.48) KDM4ESMN1; SMN2HTTSLC2A1ANPEP
SCHEMBL12857497 0.80 KDM4E (0.63) KDM4ESMN1; SMN2HTTKMT2AADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3078409-B1 ACIDIC GAS ABSORBING AGENT, METHOD FOR REMOVING ACIDIC GAS AND APPARATUS FOR REMOVING ACIDIC GAS TOSHIBA KK (JP) 2019-01-09 EP disclosed
CN-106039931-A Acidic gas absorbing agent, method for removing acidic gas and apparatus for removing acidic gas 株式会社东芝 2016-10-26 CN disclosed
EP-3078409-A1 ACIDIC GAS ABSORBING AGENT, METHOD FOR REMOVING ACIDIC GAS AND APPARATUS FOR REMOVING ACIDIC GAS Kabushiki Kaisha Toshiba (JP) 2016-10-12 EP disclosed
US-7687507-B2 Pyrrolo[2,3-d]pyrimidine compounds PFIZER INC. (US) 2010-03-30 US disclosed
US-20050171128-A1 Pyrrolo[2,3-d]pyrimidine compounds PFIZER INC 2005-08-04 US disclosed
US-6890929-B2 Immunosuppressants; lupus, multiple sclerosis, skin disorders, antiarthritic agents, antihistamines, antiulcer agents, Crohn's disease PFIZER, INC. (US) 2005-05-10 US disclosed
EP-1087970-B1 PYRROLO 2,3-d]PYRIMIDINE COMPOUNDS PFIZER PROD INC (US) 2004-04-28 EP disclosed
CN-1131213-C Carbostyril derivatives as antithrombotic agents NISHI MEDICAL RES INST CO LTD (JP) 2003-12-17 CN disclosed
US-20030212273-A1 Pyrrolo [2,3-D] pyrimidine compounds PFIZER INC. 2003-11-13 US disclosed
US-6610847-B2 Tyrosine kinase inhibitors; immunosuppressants PFIZER INC. 2003-08-26 US disclosed
US-20020019526-A1 Pyrrolo[2,3-d]pyrimidine compounds PFIZER INC. 2002-02-14 US disclosed
EP-0796248-B1 CARBOSTYRIL DERIVATIVES AS ANTITHROMBOTIC AGENTS WESTERN THERAPEUTICS INST D (JP) 2001-08-16 EP disclosed
US-6143763-A Carbostyril derivatives D. WESTERN THERAPEUTICS INSTITIUTE (JP) 2000-11-07 US disclosed
CN-1172478-A Quinolone derivative antithrombotic agent OTSUKA PHARMA CO LTD (JP) 1998-02-04 CN disclosed
EP-0796248-A1 CARBOSTYRIL DERIVATIVES AS ANTITHROMBOTIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-09-24 EP disclosed
WO-1997012869-A1 CARBOSTYRIL DERIVATIVES AS ANTITHROMBOTIC AGENTS OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-04-10 WO disclosed
US-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US 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-20020019526-A1 Pyrrolo[2,3-d]pyrimidine compounds JAK1, JAK3, JAK2 KDM4E 1999/4885SMN1; SMN2 3484/4885HTT 4247/4885
US-20050171128-A1 Pyrrolo[2,3-d]pyrimidine compounds JAK3, JAK1, JAK2 KDM4E 1567/4885SMN1; SMN2 3594/4885HTT 4169/4885
US-20030212273-A1 Pyrrolo [2,3-D] pyrimidine compounds JAK1, JAK3, JAK2 KDM4E 1999/4885SMN1; SMN2 3484/4885HTT 4247/4885

“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.