SCHEMBL14640344

SCHEMBL14640344

COc1ccc(Cl)cc1C1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 9/20 0.62
PTGDR Q13258 5/20 0.62
PTGER2 P43116 1/20 0.58
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTR2A P28223 3/20 0.45
POLB P06746 1/20 0.44
HTR2C P28335 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL1266524 0.85 PTGDR2 (0.49) PTGDR2PTGDRPTGER2MEN1KMT2A
SCHEMBL12896972 0.85 PTGDR2 (0.49) PTGDR2PTGDRPTGER2MEN1KMT2A
SCHEMBL1093945 0.83 HTR2C (0.61) PTGDR2PTGDRHTR2AHTR2C
SCHEMBL24252872 0.83 PTGDR2 (0.46) PTGDR2PTGDRPTGER2MEN1KMT2A
SCHEMBL12896664 0.82 OPRM1 (0.53) PTGDR2PTGDRPTGER2MEN1KMT2A
Hydrochloric Acid SCHEMBL1266139 0.82 HTR2C (0.62) PTGDR2PTGDRHTR2AHTR2C
SCHEMBL10534970 0.81 PTGDR2 (0.60) PTGDR2PTGDRTSHRL3MBTL1HTR2A
SCHEMBL4572970 0.81 PTGDR2 (0.49) PTGDR2PTGDRPTGER2MEN1KMT2A
SCHEMBL4888059 0.80 PTGDR2 (0.64) PTGDR2PTGDRPTGER2MEN1KMT2A
SCHEMBL11819421 0.79 HTR2A (0.53) PTGDR2PTGDRMEN1KMT2ATSHR

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
WO-2007006547-A1 AMIDE DERIVATIVES AS KINASE INHIBITORS DEVGEN N.V. (BE) 2007-01-18 WO disclosed