SCHEMBL2973276

SCHEMBL2973276

FC(F)(F)c1ccccc1C=C1CCN(c2cc[c]cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.44
TNF P01375 1/20 0.43
IL6 P05231 1/20 0.43
MYC P01106 1/20 0.36
MAX P61244 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
GRIN2D O15399 2/20 0.35
GRIN3B O60391 2/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
GRIN2B Q13224 2/20 0.35
GRIN2C Q14957 2/20 0.35
GRIN3A Q8TCU5 2/20 0.35
NFKB1 P19838 1/20 0.34
BCL2L1 Q07817 3/20 0.34
BCL2 P10415 2/20 0.34
CYP24A1 Q07973 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL376567 0.83 KDM4E (0.44) CCR3TNFIL6MYCMAX
SCHEMBL1742861 0.80 HPGD (0.45) CCR3TNFIL6BCL2L1BCL2
SCHEMBL376896 0.79 F2 (0.49) CCR3TNFIL6GRIN2DGRIN3B
SCHEMBL25375799 0.77 TNF (0.59) CCR3TNFIL6MYCMAX
SCHEMBL1742121 0.74 ALDH1A1 (0.44) MAPK1HTTBCL2L1BCL2KMT2A
SCHEMBL5808456 0.73 RORC (0.46) CCR3TNFIL6NFKB1BCL2L1
SCHEMBL4252698 0.72 TNF (0.48) CCR3TNFIL6MYCMAX
SCHEMBL5015224 0.70 TNF (0.51) CCR3TNFIL6MYCMAX
SCHEMBL4259286 0.70 GRM5 (0.46) TNFIL6MAPK1NFKB1KMT2A
SCHEMBL5805819 0.70 SCD (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888543-B1 APOPTOSIS PROMOTERS ABBOTT LAB (US) 2012-08-01 EP disclosed
US-7777076-B2 Macrocyclic inhibitors of BCL proteins ABBOTT LABORATORIES (US) 2010-08-17 US disclosed
US-20080194691-A1 Apoptosis Promoters ABBOTT LABORATORIES (US) 2008-08-14 US disclosed
EP-1888543-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2008-02-20 EP disclosed
WO-2006127364-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2006-11-30 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-20080194691-A1 Apoptosis Promoters BAX, BCL2, BCOR CCR3 2310/4885TNF 2358/4885IL6 3889/4885

“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.