SCHEMBL9811245

SCHEMBL9811245

O=C1NNC[C@H]1NC(=O)C(Cl)(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.37
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
NAAA Q02083 4/20 0.30
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
CXCR4 P61073 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
SCHEMBL9811251 1.00 CCR2 (0.37) CCR2ALDH1A1POLBNAAACCR1
SCHEMBL9811241 1.00 CCR2 (0.37) CCR2ALDH1A1POLBNAAACCR1
SCHEMBL9811278 0.75 NAAA (0.40) CCR2ALDH1A1NAAA
SCHEMBL9811270 0.75 NAAA (0.40) CCR2ALDH1A1NAAA
SCHEMBL9811160 0.74 ALDH1A1 (0.60) ALDH1A1POLBNAAA
SCHEMBL9811313 0.71 GAA (0.57) NAAA
SCHEMBL9811238 0.71 GAA (0.57) NAAA
SCHEMBL9811323 0.71 GAA (0.57) NAAA
SCHEMBL20469902 0.66
SCHEMBL9811334 0.65 NAAA (0.41) NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0202795-B1 4-SUBSTITUTED DIAZOLIDINONES ELI LILLY AND COMPANY (US) 1991-06-12 EP disclosed
US-4826993-A Substituted diazolidinones ELI LILLY AND COMPANY (US) 1989-05-02 US disclosed
EP-0202795-A1 4-Substituted diazolidinones ELI LILLY AND COMPANY (US) 1986-11-26 EP disclosed