SCHEMBL29800237

SCHEMBL29800237

COc1ccc(/C=C(/C#N)c2cccnc2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 1.00
▸ EGFR P00533 2/20 1.00
▸ RECQL P46063 1/20 1.00
▸ HIF1A Q16665 1/20 1.00
▸ PDGFRB P09619 1/20 1.00
▸ PDGFRA P16234 1/20 1.00
▸ MAPT P10636 4/20 0.60
▸ POLB P06746 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ CYP1A1 P04798 1/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ CYP2D6 P10635 1/20 0.58
▸ CYP1B1 Q16678 1/20 0.58
▸ KDM4E B2RXH2 2/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ CLK1 P49759 2/20 0.52
▸ DYRK1A Q13627 2/20 0.52

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
SCHEMBL1959494 1.00 SMN1; SMN2 (1.00) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL31060645 1.00 SMN1; SMN2 (1.00) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL241869 1.00 SMN1; SMN2 (1.00) SMN1; SMN2EGFRRECQLHIF1APDGFRB
Hydrochloric Acid SCHEMBL1957337 0.99 SMN1; SMN2 (0.98) SMN1; SMN2EGFRRECQLHIF1APDGFRB
Hydrochloric Acid SCHEMBL1957339 0.99 SMN1; SMN2 (0.98) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL6782221 0.90 EGFR (0.82) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL6782225 0.90 EGFR (0.82) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL6782228 0.90 EGFR (0.82) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL17232854 0.90 EGFR (0.82) SMN1; SMN2EGFRRECQLHIF1APDGFRB
SCHEMBL17232864 0.87 SMN1; SMN2 (0.77) SMN1; SMN2EGFRRECQLHIF1APDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12281117-B2 Small molecule immune agonists and immune targeting compounds and application thereof SHENZHEN UNIVERSITY (CN) 2025-04-22 — — US disclosed
US-20230364243-A1 CANCER-SELECTIVE TARGET DEGRADATION BY TARGETING GROUP CAGED PROTACS BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2023-11-16 — — US disclosed
WO-2022165185-A9 CANCER-SELECTIVE TARGET DEGRADATION BY TARGETING GROUP CAGED PROTACS BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2022-12-01 — — WO disclosed
US-20220288207-A1 PHOTO INDUCED CONTROL OF PROTEIN DESTRUCTION BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2022-09-15 — — US disclosed
WO-2022165185-A1 CANCER-SELECTIVE TARGET DEGRADATION BY TARGETING GROUP CAGED PROTACS BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2022-08-04 — — WO disclosed
WO-2022159687-A1 PHENOTYPIC ASSAY TO IDENTIFY PROTEIN DEGRADERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-07-28 — — WO 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 (3 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-12281117-B2 Small molecule immune agonists and immune targeting compounds and application thereof IFNG, IFNAR1, STING1 SMN1; SMN2 4778/4885EGFR 517/4885RECQL 2022/4885
US-20230364243-A1 CANCER-SELECTIVE TARGET DEGRADATION BY TARGETING GROUP CAGED PROTACS ADRM1, MYC, SKP2 SMN1; SMN2 2925/4885EGFR 268/4885RECQL 2555/4885
US-20220288207-A1 PHOTO INDUCED CONTROL OF PROTEIN DESTRUCTION UBE3C, PSMC1, UBE3A SMN1; SMN2 4208/4885EGFR 2133/4885RECQL 2105/4885

“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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