SCHEMBL6352149

SCHEMBL6352149

COC(=O)c1cc(Oc2ccc(OS(=O)(=O)C(F)(F)F)cc2)cc(C(=O)OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.48
USP2 O75604 1/20 0.46
RAB9A P51151 1/20 0.46
CXCR2 P25025 2/20 0.45
LMNA P02545 2/20 0.41
CXCR1 P25024 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
PTPN1 P18031 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NOTUM Q6P988 3/20 0.39
HSD11B1 P28845 1/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.38
FAAH O00519 1/20 0.38
EPHX2 P34913 1/20 0.38
POLB P06746 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 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
SCHEMBL2188550 0.90 STS (0.59) STSRAB9ACXCR2LMNACXCR1
SCHEMBL10206864 0.89 TSHR (0.44) STSUSP2RAB9AALDH1A1SMN1; SMN2
SCHEMBL732952 0.88 NOTUM (0.45) STSUSP2RAB9ACXCR2LMNA
SCHEMBL6342428 0.85 MEN1 (0.49) RAB9ACXCR2CXCR1CA1CA2
SCHEMBL4391166 0.85 NOTUM (0.45) STSUSP2RAB9ACXCR2LMNA
SCHEMBL1928327 0.85 STS (0.65) STSRAB9ACXCR2LMNACXCR1
SCHEMBL6002200 0.82 EPAS1 (0.49) STSUSP2LMNAPTPN1ALDH1A1
SCHEMBL6132404 0.81 STS (0.59) STSRAB9ACXCR2LMNACA1
SCHEMBL730884 0.81 KDM4E (0.45) STSLMNACA1CA2ALDH1A1
Methylparaben SCHEMBL5481174 0.79 CA1 (0.61) STSRAB9ACXCR2LMNACXCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949674-B2 Aromatic carboxylic acids, acid halides thereof and processes for preparing both SUMITOMO BAKELITE COMPANY, LTD. (JP) 2005-09-27 US disclosed
US-20040068139-A1 Aromatic carboxylic acids, acid halides thereof and processes for preparing both SUMITOMO BAKELITE COMPANY, LTD. (JP) 2004-04-08 US disclosed
EP-1346975-A1 AROMATIC CARBOXYLIC ACIDS, ACID HALIDES THEREOF AND PROCESSES FOR PREPARING BOTH SUMITOMO BAKELITE CO., LTD. (JP) 2003-09-24 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-20040068139-A1 Aromatic carboxylic acids, acid halides thereof and processes for preparing both CCR1, CCRL2, CCR6 STS 2923/4885USP2 579/4885RAB9A 2849/4885

“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.