SCHEMBL16680705

SCHEMBL16680705

CCCCOC(=O)NC(Cc1ccc(C(F)F)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 12/20 0.48
ITGA2B P08514 12/20 0.48
ITGB1 P05556 3/20 0.47
ITGA4 P13612 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ACE P12821 2/20 0.45
ACE2 Q9BYF1 2/20 0.45
MME P08473 1/20 0.45
CPA1 P15085 1/20 0.45
MAPK1 P28482 1/20 0.44

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
SCHEMBL3663289 0.88 ACE (0.51) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL2252892 0.86 FOLH1 (0.56) ITGB3ITGA2BITGB1ITGA4SMN1; SMN2
SCHEMBL2252894 0.86 FOLH1 (0.56) ITGB3ITGA2BITGB1ITGA4SMN1; SMN2
SCHEMBL5086266 0.86 ITGB1 (0.56) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL5085763 0.86 ITGB1 (0.56) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL844471 0.86 ITGB3 (0.58) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL2185240 0.86 ITGB3 (0.58) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL7758997 0.86 ITGB3 (0.58) ITGB3ITGA2BITGB1ITGA4ACE
SCHEMBL2320402 0.85 FPR2 (0.54) ITGB3ITGA2BITGB1ITGA4
SCHEMBL15201783 0.85 MME (0.61) 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
US-9452990-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2016-09-27 US disclosed
US-20150126492-A1 Complement Pathway Modulators and Uses Thereof NOVARTIS AG (CH) 2015-05-07 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-20150126492-A1 Complement Pathway Modulators and Uses Thereof CFB, CFH, TFPI ITGB3 365/4885ITGA2B 101/4885ITGB1 135/4885

“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.