SCHEMBL22901464

SCHEMBL22901464

CNC(=O)[C@@H](NC(=O)[C@@H](N(C)C)C(C)(C)c1ccccc1)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.48
MMP3 P08254 9/20 0.48
MMP1 P03956 6/20 0.48
ADAM17 P78536 6/20 0.48
TNF P01375 1/20 0.48
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
MMP9 P14780 1/20 0.46
MMP14 P50281 1/20 0.46
MMP13 P45452 4/20 0.45
MMP8 P22894 1/20 0.45
MMP12 P39900 1/20 0.45

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
SCHEMBL14233744 0.83 TUBB1 (0.42) MMP2MMP3MMP1ADAM17TNF
SCHEMBL22111365 0.83 ALDH1A1 (0.43)
SCHEMBL16644131 0.79 TUBB1 (0.49) MMP2MMP3MMP1ADAM17
SCHEMBL22661839 0.77 CNR2 (0.39) MMP2MMP3MMP1ADAM17TNF
SCHEMBL19522596 0.76 TUBB1 (0.41) MMP2MMP3MMP1ADAM17TNF
SCHEMBL20015459 0.76 TUBB1 (0.41) MMP2MMP3MMP1ADAM17TNF
SCHEMBL6674366 0.76 TUBB1 (0.64) MMP2MMP3MMP1ADAM17TNF
SCHEMBL16730694 0.76 TUBB1 (0.41) MMP2MMP3MMP1ADAM17TNF
SCHEMBL14233968 0.76 TUBB1 (0.64) MMP2MMP3MMP1ADAM17TNF
SCHEMBL88817 0.75 TUBB1 (0.51) MMP2MMP3MMP1ADAM17TNF

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-20210017274-A1 Drug-Conjugates With a Targeting Molecule and Two Different Drugs SORRENTO THERAPEUTICS, INC. (US) 2021-01-21 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-20210017274-A1 Drug-Conjugates With a Targeting Molecule and Two Different Drugs ERBB2, ABCG2, DYNLL2 MMP2 3070/4885MMP3 3186/4885MMP1 4166/4885

“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.