SCHEMBL6782221

SCHEMBL6782221

COc1ccc(/C=C(\C#N)c2cccnc2)cc1O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.82
▸ SMN1; SMN2 Q16637 2/20 0.82
▸ RECQL P46063 1/20 0.82
▸ HIF1A Q16665 1/20 0.82
▸ PDGFRB P09619 1/20 0.82
▸ PDGFRA P16234 1/20 0.82
▸ TUBB4A P04350 2/20 0.65
▸ TUBB P07437 2/20 0.65
▸ TUBA3C P0DPH7 2/20 0.65
▸ TUBA1B P68363 2/20 0.65
▸ TUBA4A P68366 2/20 0.65
▸ TUBB4B P68371 2/20 0.65
▸ TUBB3 Q13509 2/20 0.65
▸ TUBB2A Q13885 2/20 0.65
▸ TUBB8 Q3ZCM7 2/20 0.65
▸ TUBA3E Q6PEY2 2/20 0.65
▸ TUBA1A Q71U36 2/20 0.65
▸ TUBA1C Q9BQE3 2/20 0.65
▸ TUBB6 Q9BUF5 2/20 0.65
▸ TUBB2B Q9BVA1 2/20 0.65

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
SCHEMBL6782228 1.00 EGFR (0.82) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL6782225 1.00 EGFR (0.82) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL31060645 0.90 SMN1; SMN2 (1.00) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL29800237 0.90 SMN1; SMN2 (1.00) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL1959494 0.90 SMN1; SMN2 (1.00) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL241869 0.90 SMN1; SMN2 (1.00) EGFRSMN1; SMN2RECQLHIF1APDGFRB
Hydrochloric Acid SCHEMBL1957339 0.89 SMN1; SMN2 (0.98) EGFRSMN1; SMN2RECQLHIF1APDGFRB
Hydrochloric Acid SCHEMBL1957337 0.89 SMN1; SMN2 (0.98) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL17232854 0.86 EGFR (0.82) EGFRSMN1; SMN2RECQLHIF1APDGFRB
SCHEMBL17232864 0.83 SMN1; SMN2 (0.77) EGFRSMN1; SMN2RECQLHIF1APDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015166042-A1 STILBENE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CANCER DE MONTFORT UNIVERSITY (GB) 2015-11-05 — — WO disclosed
US-6677383-B1 SUPRRESION OF TUMORS CONTAINING OXIDOREDUCTASE ENZYMES, BY CONTACTING THE CELLS WITH ANTITUMOR CHEMICAL INTERMEDIATES SUCH AS 3,4,5-TRIMETHOXY-4'-METHOXYSTILBENE DE MONTFORT UNIVERSITY (GB) 2004-01-13 — — US disclosed
US-6346550-B2 TYROSINE KINASE INHIBITOR; ANTITUMOR AGENT DE MONTFORT UNIVERSITY (GB) 2002-02-12 — — US disclosed
US-20010021717-A1 Hydroxylation activated prodrugs DE MONTFORT UNIVERSITY 2001-09-13 — — US disclosed
US-6214886-B1 INHIBITING GROWTH OF TUMOR CELLS VIA STYRENE-DERIVED PRODRUGS WHICH ARE ACTIVATED BY ACTIVITY OF A HYDROXYLASE DEMONTFORT UNIVERSITY, THE GATEWAY (GB) 2001-04-10 — — US disclosed
EP-1051383-A1 HYDROXYLATION ACTIVATED PRODRUGS DE MONTFORT UNIVERSITY (GB) 2000-11-15 — — EP disclosed
WO-1999040056-A1 HYDROXYLATION ACTIVATED PRODRUGS DE MONTFORT UNIVERSITY (GB) 1999-08-12 — — 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 (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-20010021717-A1 Hydroxylation activated prodrugs CYP1B1, CYP1A1, CYP1A2 EGFR 2714/4885SMN1; SMN2 4723/4885RECQL 2741/4885

“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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