SCHEMBL10162258

SCHEMBL10162258

CC(=O)C12CCC(CNC(=O)c3cc(C(=O)NCc4ccc(F)c(OC(F)(F)F)c4)nc4ncnn34)(CC1)CC2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.39
MBOAT4 Q96T53 7/20 0.38
ENPP2 Q13822 1/20 0.38
MMP13 P45452 6/20 0.36
ADAMTS4 O75173 1/20 0.36
MMP3 P08254 1/20 0.36
KCNN4 O15554 1/20 0.35
PDE2A O00408 1/20 0.35
SCN5A Q14524 1/20 0.34
SCN9A Q15858 1/20 0.34
CTSD P07339 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
SCHEMBL10162260 0.90 MBOAT4 (0.36) MBOAT4MMP13ADAMTS4MMP3PDE2A
SCHEMBL10162242 0.89 MMP13 (0.39) MMP13ADAMTS4MMP3PDE2A
SCHEMBL10162263 0.89 MMP13 (0.45) MBOAT4ENPP2MMP13ADAMTS4MMP3
SCHEMBL10162200 0.88 MMP13 (0.46) RIPK1ENPP2MMP13ADAMTS4MMP3
SCHEMBL10162240 0.88 MMP13 (0.48) MMP13ADAMTS4MMP3PDE2A
SCHEMBL10162261 0.87 GLS (0.43) RIPK1MMP13
SCHEMBL10162252 0.87 MMP13 (0.40) MMP13PDE2A
SCHEMBL10162262 0.86 SMN1; SMN2 (0.38) MMP13
SCHEMBL10162264 0.85 PDE2A (0.39) MBOAT4MMP13PDE2A
SCHEMBL10165656 0.85 RIPK1 (0.45) RIPK1MBOAT4ENPP2MMP13ADAMTS4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835441-B2 Heterobicyclic metalloprotease inhibitors AMGEN INC. (US) 2014-09-16 US disclosed
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2012-01-19 US disclosed
US-7795245-B2 Heterobicyclic metalloprotease inhibitors Atlantos Pharmaceuticals Holding, Inc. (US) 2010-09-14 US disclosed
US-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2009-12-17 US disclosed
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2009-05-28 US disclosed
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 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 (4 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-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors MMP13, TIMP3, MMP3 RIPK1 3619/4885MBOAT4 2357/4885ENPP2 259/4885
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 RIPK1 3619/4885MBOAT4 2357/4885ENPP2 259/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 RIPK1 3619/4885MBOAT4 2357/4885ENPP2 259/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 RIPK1 3619/4885MBOAT4 2357/4885ENPP2 259/4885

“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.