SCHEMBL4840863

SCHEMBL4840863

COC(=O)c1c(F)cc(OCCNC(=O)[C@@H]2Cc3ccccc3N2S(=O)(=O)c2ccc(-c3ccc(F)cc3Cl)cc2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 1/20 0.39
MAPT P10636 3/20 0.38
TRPA1 O75762 6/20 0.36
MMP8 P22894 4/20 0.36
MMP3 P08254 2/20 0.36
POLB P06746 1/20 0.36
RORC P51449 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GNRHR P30968 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35

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
SCHEMBL4842953 0.94 PTGER3 (0.40) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4843193 0.93 PTGER3 (0.40) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4841297 0.92 MAPT (0.41) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4843296 0.92 PTGER3 (0.39) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4843191 0.92 TRPA1 (0.36) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4837596 0.91 PTGER3 (0.43) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4842178 0.88 PTGER3 (0.37) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4842704 0.88 GNRHR (0.36) MAPTTRPA1POLBRORCSMN1; SMN2
SCHEMBL4840897 0.88 MMP8 (0.37) PTGER3MAPTTRPA1MMP8MMP3
SCHEMBL4840886 0.87 MMP8 (0.42) MAPTTRPA1MMP8MMP3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 PTGER3 3044/4885MAPT 763/4885TRPA1 368/4885

“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.