SCHEMBL4842616

SCHEMBL4842616

NCCc1ccc(OCCC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
LMNA P02545 1/20 0.61
FFAR4 Q5NUL3 2/20 0.53
MMP2 P08253 1/20 0.51
S1PR1 P21453 4/20 0.51
S1PR3 Q99500 2/20 0.51
S1PR4 O95977 1/20 0.49

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
SCHEMBL8478544 0.86 FFAR1 (0.71) FFAR1L3MBTL1LMNAFFAR4
SCHEMBL928209 0.86 L3MBTL1 (0.62) FFAR1L3MBTL1LMNAFFAR4MMP2
Hydrochloric Acid SCHEMBL25249937 0.85 FFAR1 (0.55) FFAR1L3MBTL1LMNAS1PR1S1PR3
SCHEMBL20799670 0.83 FFAR1 (0.65) FFAR1L3MBTL1LMNAFFAR4S1PR1
SCHEMBL11949155 0.83 L3MBTL1 (0.76) FFAR1L3MBTL1LMNAFFAR4MMP2
Hydrochloric Acid SCHEMBL25249708 0.82 FFAR1 (0.55) FFAR1L3MBTL1LMNAS1PR1S1PR3
SCHEMBL4432054 0.82 ALOX15 (0.57) FFAR1
SCHEMBL12117110 0.82 L3MBTL1 (0.67) FFAR1L3MBTL1LMNAMMP2
SCHEMBL2198008 0.82 L3MBTL1 (0.67) FFAR1L3MBTL1LMNAMMP2
SCHEMBL1809723 0.81 L3MBTL1 (0.69) FFAR1L3MBTL1LMNAFFAR4

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
CN-102746214-A Novel indoline compounds FOURNIER LAB SA 2012-10-24 CN disclosed
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 FFAR1 55/4885L3MBTL1 1493/4885LMNA 1943/4885

“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.