SCHEMBL23716176

SCHEMBL23716176

CC/C(C)=C/C=C(\N)Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.40
PNMT P11086 2/20 0.39
TAAR1 Q96RJ0 2/20 0.39
NPFFR2 Q9Y5X5 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
PIK3CA P42336 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL23716267 0.87 SLC6A4 (0.34) LMNAGAACRHBPCRHR2
SCHEMBL23715780 0.86 IDO1 (0.42) IDO1PNMTTAAR1NPFFR2LMNA
SCHEMBL23715862 0.84 IDO1 (0.41) IDO1PNMTTAAR1NPFFR2LMNA
SCHEMBL23716186 0.83 IDO1 (0.41) IDO1PNMTTAAR1NPFFR2LMNA
SCHEMBL23716370 0.83 IDO1 (0.44) IDO1PNMTTAAR1NPFFR2LMNA
SCHEMBL23716015 0.74 PTPN7 (0.34) IDO1PNMTNPFFR2CRHBPCRHR2
SCHEMBL23716112 0.73 PIK3CA (0.43) IDO1PIK3CATSHR
SCHEMBL23715869 0.73 SMN1; SMN2 (0.33) IDO1NPFFR2
SCHEMBL23716287 0.72 ANO1 (0.34) PNMTTAAR1PIK3CA
SCHEMBL23716262 0.71 IDO1 (0.43) IDO1PNMTTAAR1LMNAGAA

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-3209732-B1 SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS SCRIPPS RESEARCH INST (US) 2021-08-04 EP disclosed