SCHEMBL7324612

SCHEMBL7324612

COCCCCCOc1ccc(-c2nn3c(-c4ccc(C(=O)OC)cc4)cnc3s2)cc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 11/20 0.61
MKNK2 Q9HBH9 11/20 0.61
MAPT P10636 2/20 0.46
FYN P06241 1/20 0.45
PIK3CA P42336 2/20 0.43
RAB9A P51151 1/20 0.43
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL7321701 1.00 MKNK1 (0.61) MKNK1MKNK2MAPTFYNPIK3CA
SCHEMBL7318292 1.00 MKNK1 (0.61) MKNK1MKNK2MAPTFYNPIK3CA
SCHEMBL7324198 1.00 MKNK1 (0.61) MKNK1MKNK2MAPTFYNPIK3CA
SCHEMBL6132537 0.90 MKNK1 (0.52) MKNK1MKNK2MAPTFYNHPGD
SCHEMBL6132847 0.90 MKNK1 (0.51) MKNK1MKNK2PIK3CA
SCHEMBL6132243 0.82 HDAC3 (0.52) MKNK1MKNK2MAPTRAB9AHPGD
SCHEMBL7319177 0.81 MAPT (0.56) MAPTRAB9AHTTSMN1; SMN2HDAC1
SCHEMBL7324575 0.81 MAPT (0.56) MAPTRAB9AHTTSMN1; SMN2HDAC1
SCHEMBL7397503 0.81 MAPT (0.56) MAPTRAB9AHTTSMN1; SMN2HDAC1
SCHEMBL6132721 0.81 RARB (0.59) MKNK1MKNK2

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
US-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed