SCHEMBL16124609

SCHEMBL16124609

CCCCCOC(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 9/20 0.57
ITGA2B P08514 9/20 0.57
FAAH O00519 2/20 0.54
ITGB1 P05556 2/20 0.54
ITGA4 P13612 2/20 0.54
CTSK P43235 2/20 0.53
ACE P12821 2/20 0.53
ACE2 Q9BYF1 2/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
MME P08473 1/20 0.51
CPA1 P15085 1/20 0.51

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
SCHEMBL16124604 0.99 ITGB3 (0.58) ITGB3ITGA2BFAAHITGB1ITGA4
SCHEMBL7758997 0.96 ITGB3 (0.58) ITGB3ITGA2BFAAHITGB1ITGA4
SCHEMBL844471 0.96 ITGB3 (0.58) ITGB3ITGA2BFAAHITGB1ITGA4
SCHEMBL2185240 0.96 ITGB3 (0.58) ITGB3ITGA2BFAAHITGB1ITGA4
SCHEMBL11123914 0.91 CTSL (0.54) ITGB3ITGA2BCTSKACEACE2
SCHEMBL11123913 0.91 CTSL (0.54) ITGB3ITGA2BCTSKACEACE2
SCHEMBL9186008 0.90 ACE (0.53) ITGB3ITGA2BCTSKACEACE2
SCHEMBL9936982 0.90 MME (0.61) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL15201783 0.90 MME (0.61) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL3927408 0.87 ACE (0.60) ITGB3ITGA2BITGB1ITGA4ACE

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
WO-2024043313-A1 REVERSIBLE THERMOCHROMIC COMPOSITION, MICROENCAPSULATED PIGMENT USING SAID REVERSIBLE THERMOCHROMIC COMPOSITION, WRITING TOOL, AND TOY 三菱ケミカル株式会社 2024-02-29 WO disclosed
US-20140288142-A1 NITRIC OXIDE DONOR COMPOUNDS NICOX SA (FR) 2014-09-25 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-20140288142-A1 NITRIC OXIDE DONOR COMPOUNDS NOS3, NOS2, NOS1 ITGB3 191/4885ITGA2B 224/4885FAAH 1868/4885

“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.