SCHEMBL5176371

SCHEMBL5176371

CC1COC(c2cccc(C3=NC(C)CO3)n2)=N1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
MAPT P10636 4/20 0.42
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
CCR1 P32246 1/20 0.31
CCR8 P51685 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2D6 P10635 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL28571116 1.00 KDM4E (0.44) KDM4EMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL14154741 1.00 KDM4E (0.44) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7173060 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7171375 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7181522 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7179383 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7176802 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7173073 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7173290 0.96 KDM4E (0.42) KDM4EMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL5945715 0.86 ALDH1A1 (0.50) KDM4EMAPTNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1787971-A2 Process for preparing aryl allyl ethers Dow Gloval Technologies Inc. (US) 2007-05-23 EP disclosed
EP-1546078-A1 PROCESS FOR PREPARING ARYL ALLYL ETHERS Dow Global Technologies Inc. (US) 2005-06-29 EP disclosed
US-20050033094-A1 Process for preparing aryl allyl ethers BORIACK CLINTON J (US) 2005-02-10 US disclosed
EP-1080084-B1 PROCESS FOR EPOXIDATION OF ARYL ALLYL ETHERS DOW GLOBAL TECHNOLOGIES INC (US) 2004-05-06 EP disclosed
WO-2004013076-A1 PROCESS FOR PREPARING ARYL ALLYL ETHERS DOW GLOBAL TECHNOLOGIES INC. (US) 2004-02-12 WO disclosed
US-20040024263-A1 Process for preparing aryl allyl ethers BORIACK CLINTON J (US) 2004-02-05 US disclosed
CN-1303382-A Epoxidation process for aryl allyl ethers DOW CHEMICAL CO (US) 2001-07-11 CN disclosed
EP-1080084-A2 PROCESS FOR EPOXIDATION OF ARYL ALLYL ETHERS THE DOW CHEMICAL COMPANY (US) 2001-03-07 EP disclosed
US-6087513-A REACTION OF ALLYL ARYL ETHER WITH HYDROGEN PEROXIDE IN THE PRESENCE OF TRANSITION METALS FOR OXIDATION THE DOW CHEMICAL COMPANY (US) 2000-07-11 US disclosed
WO-1999062894-A2 PROCESS FOR EPOXIDATION OF ARYL ALLYL ETHERS THE DOW CHEMICAL COMPANY (US) 1999-12-09 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 (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-20040024263-A1 Process for preparing aryl allyl ethers PICALM, AP2M1, AP1M1 KDM4E 630/4885MAPT 1368/4885NPC1 2043/4885
US-20050033094-A1 Process for preparing aryl allyl ethers PICALM, AP2M1, AP1M1 KDM4E 630/4885MAPT 1368/4885NPC1 2043/4885

“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.