SCHEMBL2903624

SCHEMBL2903624

CCCCCCCCCC(O)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.44
PLA2G2C Q5R387 1/20 0.44
CNR2 P34972 2/20 0.41
ALDH1A1 P00352 4/20 0.41
NR1I2 O75469 1/20 0.40
CA12 O43570 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
MMP9 P14780 2/20 0.40
MMP13 P45452 2/20 0.40
ADAM17 P78536 2/20 0.40
MMP1 P03956 2/20 0.40
CYP2C9 P11712 2/20 0.40
LMNA P02545 2/20 0.40
ALB P02768 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38

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
SCHEMBL28122613 1.00 MCHR1 (0.44) MCHR1PLA2G2CCNR2ALDH1A1NR1I2
SCHEMBL16039239 0.94 CA2 (0.42) MCHR1PLA2G2CCNR2ALDH1A1CA12
SCHEMBL1545377 0.88 CA2 (0.47) ALDH1A1CA12CA2CA9MMP9
SCHEMBL1545434 0.88 CA2 (0.47) ALDH1A1CA12CA2CA9MMP9
SCHEMBL1545381 0.88 CA2 (0.47) ALDH1A1CA12CA2CA9MMP9
SCHEMBL5151398 0.85 TDP1 (0.43) ALDH1A1MMP9MMP13MMP1TDP1
SCHEMBL5279498 0.85 MCHR1 (0.47) MCHR1PLA2G2CCNR2ALDH1A1NR1I2
SCHEMBL3086955 0.85 MCHR1 (0.47) MCHR1PLA2G2CCNR2ALDH1A1NR1I2
SCHEMBL15272323 0.85 MCHR1 (0.47) MCHR1PLA2G2CCNR2ALDH1A1NR1I2
SCHEMBL5902719 0.85 MCHR1 (0.47) MCHR1PLA2G2CCNR2ALDH1A1NR1I2

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
US-7833993-B2 Immunomodulatory compounds and methods of use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-11-16 US disclosed
EP-1439184-B1 Immunological adjuvant compounds EISAI R&D MAN CO LTD (JP) 2010-06-16 EP disclosed
US-7560584-B2 Immunomodulatory compounds and methods of use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-07-14 US disclosed
EP-2039361-A2 Use of immunomodulatory compounds Eisai R&D Management Co., Ltd. (JP) 2009-03-25 EP disclosed
EP-1511499-B1 IMMUNOMODULATORY COMPOUNDS AND METHODS OF USE THEREOF EISAI R&D MAN CO LTD (JP) 2008-12-03 EP disclosed
US-20050164988-A1 Immunomodulatory compounds and methods of use thereof EISAI CO., LTD. (JP) 2005-07-28 US disclosed
US-20050123566-A1 Immunomodulatory compounds and methods of use thereof EISAI CO., LTD (JP) 2005-06-09 US disclosed
US-6835721-B2 Phosphate or ammonium compounds that function as immunological adjuvants when co-administered with antigens such as vaccines for bacterial and viral diseases EISAI CO., LTD. (JP) 2004-12-28 US disclosed
EP-1439184-A1 Immunological adjuvant compounds Eisai Co., Ltd. (JP) 2004-07-21 EP disclosed
EP-1147117-B1 IMMUNOLOGICAL ADJUVANT COMPOUNDS EISAI CO LTD (JP) 2004-06-16 EP disclosed
US-20040006242-A1 Immunomodulatory compounds and method of use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-01-08 US disclosed
US-20030153532-A1 Immunomodulatory compounds and methods of use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-08-14 US disclosed
US-6551600-B2 A phosphate derivative when co-administered with antigens such as vaccines for bacterial and viral diseases function as immunological adjuvant EISAI CO., LTD. (JP) 2003-04-22 US disclosed
US-20020176861-A1 Immunological adjuvant compounds compositions and methods of use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2002-11-28 US disclosed
EP-1147117-A1 IMMUNOLOGICAL ADJUVANT COMPOUNDS Eisai Co., Ltd. (JP) 2001-10-24 EP disclosed
US-6290973-B1 VACCINES FOR BACTERIAL AND VIRAL DISEASES EISAI CO., LTD. (JP) 2001-09-18 US disclosed
WO-2000044758-A1 IMMUNOLOGICAL ADJUVANT COMPOUND EISAI CO., LTD. (JP) 2000-08-03 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 (5 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-20050123566-A1 Immunomodulatory compounds and methods of use thereof TLR5, TLR3, TLR6 MCHR1 2418/4885PLA2G2C 230/4885CNR2 1164/4885
US-20020176861-A1 Immunological adjuvant compounds compositions and methods of use thereof TLR5, MYD88, TLR3 MCHR1 2944/4885PLA2G2C 61/4885CNR2 2154/4885
US-20050164988-A1 Immunomodulatory compounds and methods of use thereof TSLP, IL5, ICOS MCHR1 2495/4885PLA2G2C 600/4885CNR2 317/4885
US-20040006242-A1 Immunomodulatory compounds and method of use thereof IL5, ICOS, TSLP MCHR1 2434/4885PLA2G2C 679/4885CNR2 326/4885
US-20030153532-A1 Immunomodulatory compounds and methods of use thereof TLR5, TLR3, TLR6 MCHR1 2418/4885PLA2G2C 230/4885CNR2 1164/4885

“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.