Ethylenediamine

Ethylenediamine

SCHEMBL3262122

NCCN.O=P(O)(O)OCCCCOP(=O)(O)O

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Ethylenediamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 8/20 0.62
▸ LPAR2 Q9HBW0 6/20 0.62
▸ LPAR1 Q92633 4/20 0.62
▸ ITPR3 Q14573 1/20 0.43
▸ ITPR1 Q14643 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ CSNK2A2 P19784 1/20 0.40
▸ CSNK2B P67870 1/20 0.40
▸ CSNK2A1 P68400 1/20 0.40
▸ CSNK2A3 Q8NEV1 1/20 0.40
▸ TPI1 P60174 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GABBR2 O75899 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ THPO P40225 1/20 0.39

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
SCHEMBL182837 0.95 LPAR3 (0.58) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4534097 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4536780 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
Phosphoric Acid SCHEMBL11284267 0.93 LPAR3 (0.56) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL5575581 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4538726 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4519325 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4537351 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4535627 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1
SCHEMBL4529652 0.93 LPAR3 (0.61) LPAR3LPAR2LPAR1ITPR3ITPR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62153952-A — — None — — JP disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 — — WO disclosed
US-10265252-B2 Odor-reducing developer for oxidation dyes HENKEL AG & CO. KGAA (DE) 2019-04-23 — — US disclosed
US-20170340531-A1 ODOR-REDUCING DEVELOPER FOR OXIDATION DYES HENKEL AG & CO. KGAA (DE) 2017-11-30 — — US disclosed
EP-2021345-B1 HYDROXYLATED AMIDE SKIN MOISTURIZER OREAL (FR) 2013-07-10 — — EP disclosed
US-20100009931-A1 ASSOCIATION OF A TENSOR AGENT OR DEVICE AND A SACCHARIDE COMPOUND L'OREAL (FR) 2010-01-14 — — US disclosed
US-20070092473-A1 Cosmetic composition containing a statistical polymer with a linear main chain of ethylenic nature L'OREAL (FR) 2007-04-26 — — US disclosed
JP-S62153952-A DEVELOPMENT PROCESSING METHOD FOR BLACK AND WHITE SILVER HALIDE PHOTOGRAPHIC MATERIAL FUJI PHOTO FILM CO LTD 1987-07-08 — — JP 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 (4 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-10265252-B2 Odor-reducing developer for oxidation dyes HAO2, AOX1, LPO LPAR3 1194/4885LPAR2 985/4885LPAR1 1135/4885
US-20170340531-A1 ODOR-REDUCING DEVELOPER FOR OXIDATION DYES HAO2, AOX1, LPO LPAR3 1194/4885LPAR2 985/4885LPAR1 1135/4885
US-20100009931-A1 ASSOCIATION OF A TENSOR AGENT OR DEVICE AND A SACCHARIDE COMPOUND PIEZO1, TRPA1, TREH LPAR3 1768/4885LPAR2 1958/4885LPAR1 1622/4885
US-20070092473-A1 Cosmetic composition containing a statistical polymer with a linear main chain of ethylenic nature H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TELO2, METTL14 LPAR3 2539/4885LPAR2 3015/4885LPAR1 3106/4885

“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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