SCHEMBL2489702

SCHEMBL2489702

CCC(C(=O)O)n1c2c(c3cc(F)ccc31)C[C@@H](N(CC1CCCCC1)C(=O)CCc1ccccc1OC)CC2

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR6 P50406 1/20 0.38

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
SCHEMBL2489705 1.00 PTGDR2 (0.41) PTGDR2MEN1KMT2AHTR6
SCHEMBL1905595 0.96 PTGDR2 (0.42) PTGDR2MEN1KMT2AHTR6
SCHEMBL1905596 0.96 PTGDR2 (0.42) PTGDR2MEN1KMT2AHTR6
SCHEMBL1899571 0.89 PTGDR2 (0.44) PTGDR2MEN1KMT2AHTR6
SCHEMBL1902071 0.89 PTGDR2 (0.42) PTGDR2MEN1KMT2AHTR6
SCHEMBL1902073 0.89 PTGDR2 (0.42) PTGDR2MEN1KMT2AHTR6
SCHEMBL1899574 0.89 PTGDR2 (0.44) PTGDR2MEN1KMT2AHTR6
SCHEMBL1902118 0.89 MEN1 (0.47) PTGDR2MEN1KMT2AHTR6
SCHEMBL1902116 0.89 MEN1 (0.47) PTGDR2MEN1KMT2AHTR6
SCHEMBL1902281 0.88 PTGDR2 (0.41) PTGDR2MEN1KMT2AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2051962-B1 (3-AMINO-1,2,3,4-TETRAHYDRO-9H-CARBAZOL-9-YL)-ACETIC ACID DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2011-10-26 EP disclosed