SCHEMBL3208638

SCHEMBL3208638

C=C(C)COc1cc(O)ccc1NC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.47
BRD4 O60885 8/20 0.45
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 0.42
RAB9A P51151 3/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 2/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CCR1 P32246 2/20 0.41
LMNA P02545 3/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GPR174 Q9BXC1 1/20 0.40

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
SCHEMBL6215373 0.84 ALDH1A1 (0.50) CYP19A1BRD4KDM4EALDH1A1HSD17B10
SCHEMBL3200987 0.82 ALDH1A1 (0.45) CYP19A1BRD4KDM4EALDH1A1HSD17B10
SCHEMBL11750380 0.81 LMNA (0.50) CYP19A1BRD4KDM4EALDH1A1RAB9A
SCHEMBL6212540 0.80 BRD4 (0.63) BRD4KDM4EALDH1A1HSD17B10RAB9A
SCHEMBL14782205 0.78 HSD17B1 (0.57) ALDH1A1RAB9APOLBNPC1MAPT
SCHEMBL8715887 0.78 ALDH1A1 (0.47) BRD4KDM4EALDH1A1HSD17B10RAB9A
SCHEMBL29256012 0.76 ABL1 (0.48) BRD4KDM4EALDH1A1HSD17B10RAB9A
SCHEMBL4185400 0.76 CYP19A1 (0.44) CYP19A1BRD4RAB9APOLBNPC1
SCHEMBL14391451 0.76 CCR1 (0.48) CYP19A1BRD4ALDH1A1HSD17B10RAB9A
SCHEMBL27746846 0.76 BRD4 (0.43) CYP19A1BRD4RAB9APOLBNPC1

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
US-20100041905-A1 Process for the Preparation of Substituted 2-Acetylamino-Alkoxyphenyl ASTRAZENECA AB (SE) 2010-02-18 US claimed
EP-2044045-A2 A PROCESS FOR THE PREPARATION OF SUBSTITUTED 2-ACETYLAMINO-ALKOXYPHENYL AstraZeneca AB (SE) 2009-04-08 EP claimed
WO-2008010764-A2 A PROCESS FOR THE PREPARATION OF SUBSTITUTED 2-ACETYLAMINO-ALKOXYPHENYL ASTRAZENECA AB (SE) 2008-01-24 WO claimed
US-20100041905-A1 Process for the Preparation of Substituted 2-Acetylamino-Alkoxyphenyl ASTRAZENECA AB (SE) 2010-02-18 US disclosed
US-20100041905-A1 Process for the Preparation of Substituted 2-Acetylamino-Alkoxyphenyl ASTRAZENECA AB (SE) 2010-02-18 US disclosed
US-20100041905-A1 Process for the Preparation of Substituted 2-Acetylamino-Alkoxyphenyl ASTRAZENECA AB (SE) 2010-02-18 US disclosed
WO-2008010764-A2 A PROCESS FOR THE PREPARATION OF SUBSTITUTED 2-ACETYLAMINO-ALKOXYPHENYL ASTRAZENECA AB (SE) 2008-01-24 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-20100041905-A1 Process for the Preparation of Substituted 2-Acetylamino-Alkoxyphenyl F12, RPS4Y1, CCNA1 CYP19A1 75/4885BRD4 2714/4885KDM4E 989/4885

“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.