SCHEMBL19427093

SCHEMBL19427093

CC(C)(C)OC(=O)Cc1c[nH]c2c(CC(C)(C)OC(=O)Cc3cn(CC(C(=O)OCc4ccccc4)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c4cccnc34)ccnc12

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ POLB P06746 1/20 0.30

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
SCHEMBL19410144 0.89 TPSAB1 (0.34) MAPTXBP1NPSR1TDP1POLB
SCHEMBL31189245 0.89 TPSAB1 (0.34) MAPTXBP1NPSR1TDP1POLB
SCHEMBL19410228 0.79 MTNR1A (0.33) —
SCHEMBL19410193 0.77 L3MBTL1 (0.44) —
SCHEMBL19410146 0.69 SLC7A5 (0.38) MAPT
SCHEMBL19410199 0.67 PLK1 (0.46) MAPT
SCHEMBL19410213 0.65 ALDH1A1 (0.43) NPSR1POLB
SCHEMBL19410194 0.63 PLK1 (0.42) —
SCHEMBL16284728 0.63 SYK (0.50) MAPTNPSR1TDP1POLB
SCHEMBL19410169 0.62 SLC16A3 (0.36) NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10358463-B2 Immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2019-07-23 — — US disclosed
US-20170283463-A1 IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY 2017-10-05 — — 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 (2 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-20170283463-A1 IMMUNOMODULATORS CD274, PDCD1, PDCD1LG2 MAPT 3711/4885XBP1 1222/4885NPSR1 3065/4885
US-10358463-B2 Immunomodulators CD274, PDCD1, PDCD1LG2 MAPT 3711/4885XBP1 1222/4885NPSR1 3065/4885

“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.

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