SCHEMBL6310767

SCHEMBL6310767

Cc1ccc(S(=O)(=O)N2CC[C@H](C(=O)O)[C@H]2c2ccc(F)cc2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.45
PTGDR2 Q9Y5Y4 2/20 0.43
TRPA1 O75762 1/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
FKBP1A P62942 1/20 0.41
TP53 P04637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MMP2 P08253 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MMP1 P03956 1/20 0.39
MMP7 P09237 1/20 0.39
MMP9 P14780 1/20 0.39
MMP12 P39900 1/20 0.39
MMP14 P50281 1/20 0.39
MMP15 P51511 1/20 0.39

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
SCHEMBL6319712 1.00 GLA (0.45) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL6319715 1.00 GLA (0.45) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL6309694 0.87 ALDH1A1 (0.49) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL6309688 0.87 ALDH1A1 (0.49) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL6310795 0.84 NPSR1 (0.49) MAPTLMNAPOLBMEN1KMT2A
SCHEMBL6310797 0.84 NPSR1 (0.49) MAPTLMNAPOLBMEN1KMT2A
SCHEMBL6311968 0.83 TRPA1 (0.43) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL6319673 0.83 TRPA1 (0.43) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL6311974 0.83 TRPA1 (0.43) GLAPTGDR2TRPA1MAPTLMNA
SCHEMBL5769409 0.75 L3MBTL1 (0.48) GLAPTGDR2L3MBTL1

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-20050043354-A1 NK1 antagonist PFIZER INC 2005-02-24 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-20050043354-A1 NK1 antagonist TACR2, TACR1, TAC3 GLA 4644/4885PTGDR2 395/4885TRPA1 94/4885

“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.