SCHEMBL4743497

SCHEMBL4743497

O=C1CSC(c2cc(F)cc(Cl)c2)N1c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.56
GFER P55789 4/20 0.55
HTR7 P34969 3/20 0.55
MEN1 O00255 1/20 0.55
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA9 Q16790 3/20 0.51
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50
TUBA4A P68366 1/20 0.50
TUBB4B P68371 1/20 0.50
TUBB3 Q13509 1/20 0.50
TUBB2A Q13885 1/20 0.50
TUBB8 Q3ZCM7 1/20 0.50
TUBA3E Q6PEY2 1/20 0.50
TUBA1A Q71U36 1/20 0.50
TUBA1C Q9BQE3 1/20 0.50
TUBB6 Q9BUF5 1/20 0.50

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
SCHEMBL4743912 0.95 KMT2A (0.58) KMT2AGFERHTR7MEN1CA1
SCHEMBL4743525 0.92 CA1 (0.56) KMT2AGFERHTR7MEN1CA1
SCHEMBL4746712 0.90 KMT2A (0.56) KMT2AGFERHTR7MEN1CA1
SCHEMBL4747353 0.88 KMT2A (0.52) KMT2AGFERHTR7MEN1CA1
SCHEMBL4743528 0.88 KMT2A (0.74) KMT2AGFERHTR7MEN1CA1
SCHEMBL4747309 0.87 HTR7 (0.72) KMT2AGFERHTR7MEN1CA1
SCHEMBL4746798 0.86 CA1 (0.48) KMT2AGFERHTR7MEN1CA1
SCHEMBL4747278 0.85 CA1 (0.47) KMT2AGFERHTR7MEN1CA1
SCHEMBL4743966 0.84 CA1 (0.53) KMT2AGFERHTR7MEN1CA1
SCHEMBL4744282 0.84 TUBB4A (0.55) KMT2AGFERHTR7MEN1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008112674-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2008-09-18 WO claimed
WO-2008112674-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2008-09-18 WO disclosed