SCHEMBL4276929

SCHEMBL4276929

COC(=O)C1CCN(C(=O)/C=C/c2ccc(Sc3ccc(F)cc3)cc2Cl)CC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 10/20 0.62
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 1/20 0.49
ENPP2 Q13822 2/20 0.49
ITGB2 P05107 7/20 0.46
ICAM1 P05362 7/20 0.46
F2R P25116 2/20 0.46
KDM4E B2RXH2 1/20 0.45
CCR1 P32246 1/20 0.41

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
SCHEMBL4276933 1.00 ITGAL (0.62) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL13879613 0.88 ITGAL (0.69) ITGALSMN1; SMN2ITGB2ICAM1F2R
SCHEMBL13879642 0.87 ITGAL (0.54) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL13879676 0.87 ITGAL (0.65) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL13879649 0.85 ITGAL (0.85) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4288857 0.82 ITGAL (0.51) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4288852 0.82 ITGAL (0.51) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4276982 0.81 ITGAL (0.53) ITGALNPC1RAB9AITGB2ICAM1
SCHEMBL4276975 0.81 ITGAL (0.53) ITGALNPC1RAB9AITGB2ICAM1
SCHEMBL4290317 0.79 RAB9A (0.56) ITGALNPC1RAB9ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
WO-2007047146-A2 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. (US) 2007-04-26 WO 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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 ITGAL 4495/4885NPC1 680/4885RAB9A 3148/4885

“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.