SCHEMBL19793290

SCHEMBL19793290

Cc1ccc(N2C[C@H](NC(=O)OC(C)(C)C)CC2=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.55
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
LMNA P02545 2/20 0.52
TP53 P04637 2/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL17967299 1.00 KMT2A (0.55) KMT2ATSHRMAPK1LMNATP53
SCHEMBL17967267 1.00 KMT2A (0.55) KMT2ATSHRMAPK1LMNATP53
SCHEMBL3367168 0.90 LMNA (0.52) LMNATP53POLBMAPTKDM4E
SCHEMBL3367166 0.90 LMNA (0.52) LMNATP53POLBMAPTKDM4E
SCHEMBL16491302 0.89 LMNA (0.51) LMNATP53POLBMAPTKDM4E
SCHEMBL16491301 0.89 LMNA (0.51) LMNATP53POLBMAPTKDM4E
SCHEMBL12841501 0.89 TP53 (0.58) KMT2ALMNATP53POLBMAPT
SCHEMBL16491304 0.89 LMNA (0.51) LMNATP53POLBMAPTKDM4E
SCHEMBL17383722 0.88 POLB (0.61) KMT2ALMNATP53POLBMAPT
SCHEMBL17967145 0.85 POLB (0.49) LMNATP53POLBMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428736-B Home chemokine inhibitors 癌症研究科技有限公司 2020-08-11 CN disclosed
US-20180022742-A1 AUTOTAXIN INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-01-25 US disclosed
CN-107428736-A Oneself chemotactic element inhibitor 癌症研究科技有限公司 2017-12-01 CN 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-20180022742-A1 AUTOTAXIN INHIBITORS ENPP2, RNASE1, ATXN10 KMT2A 353/4885TSHR 1495/4885MAPK1 4281/4885

“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.