SCHEMBL14280459

SCHEMBL14280459

Cc1ccc(Oc2cc(S(N)(=O)=O)ccc2NS(C)(=O)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 4/20 0.54
PTGS1 P23219 5/20 0.50
PTGS2 P35354 5/20 0.50
CYP19A1 P11511 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
MLNR O43193 1/20 0.50
LMNA P02545 1/20 0.50
MMP1 P03956 1/20 0.50
MPO P05164 1/20 0.50
GLA P06280 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
TBXA2R P21731 1/20 0.50
SLC6A2 P23975 1/20 0.50

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
SCHEMBL4575282 0.88 SOS1 (0.55) MRGPRX1PTGS1PTGS2CYP19A1CYP1A2
SCHEMBL4575511 0.88 PTGS1 (0.57) MRGPRX1PTGS1PTGS2CYP19A1CYP1A2
SCHEMBL8099526 0.84 CYP19A1 (0.42) MRGPRX1PTGS1PTGS2CYP19A1CYP1A2
SCHEMBL14564503 0.79 CYP19A1 (0.79) PTGS1PTGS2CYP19A1CYP1A2CYP2C9
SCHEMBL8091827 0.79 CA1 (0.38) MRGPRX1PTGS1PTGS2CYP19A1CYP1A2
SCHEMBL13524349 0.77 PTGS1 (0.65) MRGPRX1PTGS1PTGS2CYP19A1CYP1A2
SCHEMBL31090806 0.77 PTGS2 (0.50) MRGPRX1PTGS1PTGS2CYP19A1CYP1A2
SCHEMBL8101831 0.76 MAPK1 (0.46) PTGS1PTGS2CYP19A1CYP1A2CYP2C9
SCHEMBL8107162 0.75 PTGS1 (0.61) PTGS1PTGS2CYP19A1CYP2C9LMNA
SCHEMBL8107798 0.75 PTGS2 (0.56) PTGS1PTGS2CYP19A1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080027011-A1 Homogeneous paste and gel formulations MERIAL LIMITED 2008-01-31 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 (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-20080027011-A1 Homogeneous paste and gel formulations EPX, CAT, PEF1 MRGPRX1 3080/4885PTGS1 101/4885PTGS2 329/4885

“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.