SCHEMBL8549002

SCHEMBL8549002

CCC[C@H](N)C(=O)NCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.57
KMT2A Q03164 1/20 0.53
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MMP8 P22894 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
EGFR P00533 2/20 0.49
SRC P12931 1/20 0.49
SLC1A1 P43005 1/20 0.49
MME P08473 1/20 0.49

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
SCHEMBL7272130 0.91 SPHK1 (0.61) SPHK1KMT2A
SCHEMBL17531100 0.89 SPHK1 (0.64) SPHK1KMT2A
SCHEMBL2742291 0.87 KMT2A (0.55) KMT2AMMP8MAPTEGFRSRC
SCHEMBL2742286 0.87 KMT2A (0.55) KMT2AMMP8MAPTEGFRSRC
SCHEMBL12240253 0.87 KMT2A (0.55) KMT2AMMP8MAPTEGFRSRC
SCHEMBL5555507 0.85 SLC1A1 (0.57) SPHK1KMT2AMMP8EGFRSRC
SCHEMBL18952189 0.85 SPHK1 (0.62) SPHK1KMT2AMMP8EGFRSRC
SCHEMBL30120748 0.85 MMP2 (0.56) KMT2AMMP8EGFRSRCSLC1A1
SCHEMBL3583374 0.85 MMP2 (0.56) KMT2AMMP8EGFRSRCSLC1A1
SCHEMBL14090279 0.84 KMT2A (0.50) SPHK1KMT2AMMP8EGFRSRC

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-20100010012-A1 GLUTAMATE AGGRECANASE INHIBITORS WYETH (US) 2010-01-14 US disclosed
EP-0564924-B1 2-Oxoethyl derivatives as immunosuppressants BAYER AG (US) 1998-09-09 EP disclosed
US-5686424-A FOR TREATING INFLAMMATION MILES INC. (US) 1997-11-11 US disclosed
EP-0564924-A2 2-Oxoethyl derivatives as immunosuppressants Bayer Corporation (US) 1993-10-13 EP 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-20100010012-A1 GLUTAMATE AGGRECANASE INHIBITORS ADAMTS5, ADAMTS1, ADAMTS7 SPHK1 3635/4885KMT2A 2364/4885CA1 65/4885

“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.