SCHEMBL5174023

SCHEMBL5174023

Clc1c[nH]nc1-c1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.46
▸ CCR1 P32246 3/20 0.46
▸ CCR5 P51681 3/20 0.46
▸ CCR8 P51685 3/20 0.46
▸ LMNA P02545 3/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ METAP1 P53582 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ DOHH Q9BU89 1/20 0.46
▸ P4HTM Q9NXG6 1/20 0.46
▸ LRRK2 Q5S007 1/20 0.46
▸ METAP2 P50579 1/20 0.42
▸ PIM1 P11309 1/20 0.41
▸ NPC1 O15118 5/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ TP53 P04637 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41

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
SCHEMBL3463943 0.79 KDM4E (0.48) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL35341798 0.78 KDM4E (0.46) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL3630610 0.78 KDM4E (0.46) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL5930996 0.78 KDM4E (0.46) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL3579139 0.78 KDM4E (0.46) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL7787302 0.78 KDM4E (0.53) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL8489109 0.77 L3MBTL1 (0.44) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL27628474 0.75 TGFBR1 (0.49) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL27917937 0.74 LRRK2 (0.42) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL3391169 0.74 ERN1 (0.46) KDM4ECCR1CCR5CCR8LMNA

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 12 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
CN-1675155-A Process for preparing aryl allyl ethers DOW GLOBAL TECHNOLOGIES INC (US) 2005-09-28 — — CN 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
WO-1994029300-A1 PYRAZOLE FUNGICIDES 3-SUBSTITUTED BY A HETEROCYCLIC RING RHONE POULENC AGROCHIMIE (FR) 1994-12-22 — — 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 630/4885CCR1 421/4885CCR5 1576/4885
US-20050033094-A1 Process for preparing aryl allyl ethers PICALM, AP2M1, AP1M1 KDM4E 630/4885CCR1 421/4885CCR5 1576/4885

“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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