SCHEMBL17300282

SCHEMBL17300282

CC[C@](C)(Cc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.50
MMP8 P22894 8/20 0.46
POLB P06746 1/20 0.42
ACE P12821 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MME P08473 3/20 0.40
FPR2 P25090 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL17300284 0.86 MMP8 (0.44) RIPK1MMP8POLBACEALDH1A1
SCHEMBL17300281 0.82 ALDH1A1 (0.42) RIPK1MMP8POLBACEALDH1A1
SCHEMBL3558478 0.79 SMN1; SMN2 (0.47) RIPK1MMP8POLBACEALDH1A1
SCHEMBL3558475 0.79 SMN1; SMN2 (0.47) RIPK1MMP8POLBACEALDH1A1
SCHEMBL8578336 0.79 MMP8 (0.47) RIPK1MMP8POLBACEALDH1A1
SCHEMBL3270164 0.78 PPARA (0.55) RIPK1MMP8ALDH1A1CYP3A4CYP2C9
SCHEMBL17300285 0.77 MMP8 (0.38) RIPK1MMP8POLBACEALDH1A1
SCHEMBL1709337 0.77 RIPK1 (0.75) RIPK1MMP8ALDH1A1CYP3A4CYP2C19
SCHEMBL3270827 0.77 MMP8 (0.53) RIPK1MMP8ALDH1A1CYP3A4CYP2C9
SCHEMBL12268231 0.76 RIPK1 (0.46) RIPK1MMP8ALDH1A1CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150342882-A1 METHODS OF TREATMENT USING CADOTRIL COMPOSITIONS JOHNSON & JOHNSON CONSUMER INC. 2015-12-03 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-20150342882-A1 METHODS OF TREATMENT USING CADOTRIL COMPOSITIONS LIPA, DEGS1, ASAH2 RIPK1 2919/4885MMP8 641/4885POLB 1617/4885

“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.