SCHEMBL27737751

SCHEMBL27737751

Nc1ccc(OC(=O)C=Cc2ccc(F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.54
MEN1 O00255 3/20 0.53
HSD11B1 P28845 1/20 0.53
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
TNFRSF1A P19438 1/20 0.49
POLB P06746 1/20 0.48
MAOB P27338 1/20 0.47
MAPT P10636 1/20 0.47
CYP19A1 P11511 1/20 0.45
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45
TUBB3 Q13509 1/20 0.45
TUBB2A Q13885 1/20 0.45
TUBB8 Q3ZCM7 1/20 0.45
TUBA3E Q6PEY2 1/20 0.45

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
SCHEMBL28536397 0.92 HSD11B1 (0.62) KMT2AMEN1HSD11B1KDM4EGAA
SCHEMBL15363576 0.92 KMT2A (0.62) KMT2AMEN1KDM4EMAPTCYP19A1
SCHEMBL15364313 0.92 KMT2A (0.62) KMT2AMEN1KDM4EMAPTCYP19A1
SCHEMBL3229347 0.92 KMT2A (0.62) KMT2AMEN1KDM4EMAPTCYP19A1
SCHEMBL15364341 0.92 KMT2A (0.62) KMT2AMEN1KDM4EMAPTCYP19A1
SCHEMBL15364345 0.92 KMT2A (0.62) KMT2AMEN1KDM4EMAPTCYP19A1
SCHEMBL30775463 0.92 KMT2A (0.62) KMT2AMEN1KDM4EMAPTCYP19A1
SCHEMBL28545557 0.85 CA12 (0.57) KMT2AMEN1HSD11B1KDM4EGAA
SCHEMBL16024193 0.84 KMT2A (0.55) KMT2AMEN1KDM4EGAAMAPT
SCHEMBL21515007 0.84 CYP19A1 (0.65) KMT2AMEN1KDM4EMAPTCYP19A1

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
CN-101402611-A Compound with anti-leukocythemia liveness and method of preparing the same UNIV GUANGDONG PHARM (CN) 2009-04-08 CN disclosed