SCHEMBL11425752

SCHEMBL11425752

Cc1ccc(C(=O)Nc2c(S(=O)(=O)O)cc3ccccc3c2O)c(N)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ POLB P06746 3/20 0.42
▸ GAA P10253 2/20 0.42
▸ ADORA3 P0DMS8 1/20 0.41
▸ KDM4A O75164 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40
▸ KDM4C Q9H3R0 1/20 0.40
▸ PLG P00747 3/20 0.39
▸ KLK1 P06870 3/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ PTGER4 P35408 3/20 0.38
▸ DDX3X O00571 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ KLK6 Q92876 2/20 0.37
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PTGER2 P43116 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
SCHEMBL11429460 0.91 KMT2A (0.42) KMT2AMEN1POLBGAAADORA3
SCHEMBL11438898 0.91 ADORA3 (0.41) KMT2AMEN1POLBGAAADORA3
SCHEMBL11433572 0.85 MPL (0.41) KMT2AMEN1POLBGAAADORA3
SCHEMBL11439417 0.83 MPL (0.46) KMT2AMEN1ADORA3RAB9ADDX3X
SCHEMBL11421974 0.83 KCNMA1 (0.47) KMT2AMEN1POLBGAANPC1
SCHEMBL11432948 0.82 KMT2A (0.40) KMT2AMEN1POLBGAAADORA3
SCHEMBL11424108 0.81 ALDH1A1 (0.46) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL11425885 0.81 KMT2A (0.41) KMT2AMEN1POLBGAAADORA3
SCHEMBL11436214 0.81 RAB9A (0.41) KMT2AMEN1POLBGAAADORA3
Acetic Acid SCHEMBL11425024 0.81 MPL (0.43) KMT2AMEN1GAAADORA3RAB9A

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-4216165-A Amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
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