SCHEMBL21130432

SCHEMBL21130432

Cc1c(COc2cc(O)c(C=O)cc2Cl)cccc1-c1cnc2ccc(Br)cc2n1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 19/20 0.42
▸ PDCD1 Q15116 11/20 0.42
▸ MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL21130366 0.91 CD274 (0.48) CD274PDCD1MRGPRX4
SCHEMBL21130656 0.82 CD274 (0.47) CD274PDCD1MRGPRX4
SCHEMBL19897846 0.82 CD274 (0.54) CD274PDCD1MRGPRX4
SCHEMBL21130489 0.82 CD274 (0.59) CD274PDCD1
SCHEMBL21130596 0.81 CD274 (0.47) CD274PDCD1MRGPRX4
SCHEMBL21130475 0.80 CD274 (0.50) CD274PDCD1
SCHEMBL21130502 0.78 CD274 (0.50) CD274PDCD1
SCHEMBL18729371 0.78 CD274 (0.46) CD274PDCD1MRGPRX4
SCHEMBL29925812 0.78 CD274 (0.46) CD274PDCD1MRGPRX4
SCHEMBL20721107 0.77 CD274 (0.65) CD274PDCD1

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
CN-109689640-B Compounds useful as immunomodulators 百时美施贵宝公司 2022-01-04 — — CN disclosed
EP-3481815-B1 1,3-DIHYDROXY-PHENYL DERIVATIVES USEFUL AS IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2021-09-29 — — EP disclosed
US-10590105-B2 1,3-dihydroxy-phenyl derivatives useful as immunomodulators BRISTOL-MEYERS SQUIBB COMPANY (US) 2020-03-17 — — US disclosed
US-20190185450-A1 1,3-DIHYDROXY-PHENYL DERIVATIVES USEFUL AS IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2019-06-20 — — 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-20190185450-A1 1,3-DIHYDROXY-PHENYL DERIVATIVES USEFUL AS IMMUNOMODULATORS CD74, CD2, HAVCR2 CD274 30/4885PDCD1 46/4885MRGPRX4 252/4885
US-10590105-B2 1,3-dihydroxy-phenyl derivatives useful as immunomodulators CD74, CD2, HAVCR2 CD274 30/4885PDCD1 46/4885MRGPRX4 252/4885

“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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