SCHEMBL1457445

SCHEMBL1457445

CCCCCCCCCCCCCCCCCC(=O)NCC(C)C

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.64
MEN1 O00255 1/20 0.60
MAPK1 P28482 1/20 0.60
KMT2A Q03164 1/20 0.60
EPHX1 P07099 1/20 0.59
ASAH1 Q13510 1/20 0.55
HSP90AA1 P07900 1/20 0.55
DNM1 Q05193 2/20 0.53
CASP2 P42575 1/20 0.52
HPGD P15428 1/20 0.51
PSMB5 P28074 1/20 0.50
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
PLA2G10 O15496 1/20 0.49

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
SCHEMBL26491481 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL20876854 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL8372916 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
Tetrahydropellitorine SCHEMBL4878046 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL20883256 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL443535 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL7432688 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL1456461 1.00 FAAH (0.64) FAAHMEN1MAPK1KMT2AEPHX1
SCHEMBL9462479 0.98 FAAH (0.61) FAAHMEN1MAPK1KMT2AEPHX1
Hydrochloric Acid SCHEMBL5396087 0.96 FAAH (0.59) FAAHMEN1MAPK1KMT2AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1592418-B1 USE OF ENDOCANNABINOID-LIKE COMPOUNDS FOR TREATING CNS DEGENERATIVE DISORDERS RES & INNOVATION S P A (IT) 2017-09-06 EP disclosed
EP-3049462-A1 VISCOELASTIC MATERIAL PRODUCED BY HYDROTHERMAL LIQUEFACTION OF MICROALGAE IFSTTAR Institut Français des Sciences et Technologies des Transports, de l'Aménagement et des Réseaux (FR) 2016-08-03 EP disclosed
WO-2015044891-A1 VISCOELASTIC MATERIAL PRODUCED BY HYDROTHERMAL LIQUEFACTION OF MICROALGAE IFSTTAR (FR) 2015-04-02 WO disclosed
EP-1900365-B9 Endocannabinoid-like compounds and their use for treating dermatitis RES & INNOVATION S P A (IT) 2012-01-18 EP disclosed
EP-1900365-B1 Endocannabinoid-like compounds and their use for treating dermatitis RES & INNOVATION S P A (IT) 2011-03-30 EP disclosed
EP-1900365-A2 New endocannabinoid-like compounds and their use RESEARCH & INNOVATION SOC. COOP. A R.L. (IT) 2008-03-19 EP disclosed
EP-1592418-A2 USE IN THERAPY OF ENDOCANNABINOID-LIKE COMPOUNDS Research & Innovation Soc. Coop. A R.L. (IT) 2005-11-09 EP disclosed
US-6887921-B2 Ink follower composition for writing instruments, and process for its production THE PILOT INK CO., LTD. (JP) 2005-05-03 US disclosed
US-20050043536-A1 antagonists of urotensin II; for example, 2,6-Dichloro-N-[3-(dimethylamino-ethoxy)4-trifluoromethyl-phenyl]-4trifluoromethyl-benzenesulfonamide SMITHKLINE BEECHAM CORPORATION 2005-02-24 US disclosed
WO-2004069240-A2 USE IN THERAPY OF ENDOCANNABINOID-LIKE COMPOUNDS RESEARCH & INNOVATION SOC. COOP. A. R. L. (IT) 2004-08-19 WO disclosed
US-20030200896-A1 Ink follower composition for writing instruments, and process for its production THE PILOT INK CO., LTD. (JP) 2003-10-30 US disclosed
WO-1990003967-A1 PROCESS FOR PRODUCING LIGHT-COLOURED SALTS OF ALKYLESTERS OF ALPHA-SULPHOFATTY ACIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1990-04-19 WO disclosed
EP-0363781-A1 Process for the preparation of bright-coloured alpha-sulpho-fatty-acid alkyl ester salts Henkel Kommanditgesellschaft auf Aktien (DE) 1990-04-18 EP 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-20050043536-A1 antagonists of urotensin II; for example, 2,6-Dichloro-N-[3-(dimethylamino-ethoxy)4-trifluoromethyl-phenyl]-4trifluoromethyl-benzenesulfonamide UTS2R, SPINT2, PRSS2 FAAH 359/4885MEN1 4148/4885MAPK1 4506/4885

“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.