SCHEMBL2487963

SCHEMBL2487963

[CH2]c1cc(N)c[nH]1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL28127490 0.65
SCHEMBL28146735 0.60 TSHR (0.33)
SCHEMBL28841868 0.60 DAO (0.32)
SCHEMBL4757269 0.60
SCHEMBL22055900 0.60
SCHEMBL24091386 0.60
SCHEMBL19007328 0.60
SCHEMBL18617008 0.60
SCHEMBL4852801 0.58
SCHEMBL21653397 0.58

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
US-8486896-B2 Lipid tripeptide-based hydrogelator and hydrogel NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-16 US claimed
EP-2180027-B1 NOVEL LIPID-TRIPEPTIDE BASED HYDROGEL-FORMING AGENT AND HYDROGEL NISSAN CHEMICAL IND LTD (JP) 2011-10-26 EP claimed
US-20100279955-A1 NOVEL LIPID TRIPEPTIDE-BASED HYDROGELATOR AND HYDROGEL NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-04 US claimed
EP-2180027-A1 NOVEL LIPID-TRIPEPTIDE BASED HYDROGEL-FORMING AGENT AND HYDROGEL Nissan Chemical Industries, Ltd. (JP) 2010-04-28 EP claimed
US-8716248-B2 Lipid tripeptide-based hydrogelator and hydrogel NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-05-06 US disclosed
US-20130203687-A1 NOVEL LIPID TRIPEPTIDE-BASED HYDROGELATOR AND HYDROGEL KYUSHU UNIVERSITY (JP) 2013-08-08 US disclosed
US-8486896-B2 Lipid tripeptide-based hydrogelator and hydrogel NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-16 US disclosed
EP-2180027-B1 NOVEL LIPID-TRIPEPTIDE BASED HYDROGEL-FORMING AGENT AND HYDROGEL NISSAN CHEMICAL IND LTD (JP) 2011-10-26 EP disclosed
US-20100279955-A1 NOVEL LIPID TRIPEPTIDE-BASED HYDROGELATOR AND HYDROGEL NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-11-04 US disclosed
EP-2180027-A1 NOVEL LIPID-TRIPEPTIDE BASED HYDROGEL-FORMING AGENT AND HYDROGEL Nissan Chemical Industries, Ltd. (JP) 2010-04-28 EP disclosed