SCHEMBL7964074

SCHEMBL7964074

Cc1ccc(CC(=O)Oc2ccc(C)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.62
KMT2A Q03164 5/20 0.57
LMNA P02545 2/20 0.55
GAA P10253 1/20 0.54
TDP1 Q9NUW8 2/20 0.53
ATM Q13315 1/20 0.53
CYP19A1 P11511 1/20 0.51
NPC1 O15118 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
ABL1 P00519 1/20 0.48
RIN1 Q13671 1/20 0.48
ASAH1 Q13510 1/20 0.48

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
SCHEMBL19798040 0.94 L3MBTL1 (0.57) L3MBTL1KMT2ALMNAGAATDP1
SCHEMBL19798036 0.94 L3MBTL1 (0.57) L3MBTL1KMT2ALMNAGAATDP1
SCHEMBL19798038 0.94 L3MBTL1 (0.57) L3MBTL1KMT2ALMNAGAATDP1
SCHEMBL19798037 0.94 L3MBTL1 (0.57) L3MBTL1KMT2ALMNAGAATDP1
SCHEMBL24819498 0.93 LMNA (0.69) L3MBTL1KMT2ALMNAGAATDP1
SCHEMBL4618083 0.91 CYP19A1 (0.65) L3MBTL1KMT2ATDP1ATMCYP19A1
SCHEMBL789755 0.91 SMN1; SMN2 (0.60) L3MBTL1KMT2ALMNATDP1ATM
SCHEMBL28183303 0.83 LMNA (0.59) L3MBTL1KMT2ALMNAGAATDP1
SCHEMBL414384 0.82 SENP1 (0.59) L3MBTL1KMT2ATDP1ATMCYP19A1
SCHEMBL19599393 0.81 L3MBTL1 (0.46) L3MBTL1KMT2ALMNAGAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180022996-A1 BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA MERCK PATENT GMBH (DE) 2018-01-25 US disclosed
WO-2009120235-A1 MONOMER SOLUTION FOR PRODUCING POLYCARBONATE SABIC INNOVATIVE PLASTICS IP BV (NL) 2009-10-01 WO disclosed
US-6274583-B1 Alpha 1a adrenergic receptor antagonists MERCK & CO., INC. 2001-08-14 US disclosed
US-5977115-A Alpha 1a adrenergic receptor antagonists MERCK & CO., INC. (US) 1999-11-02 US disclosed
EP-0833637-A4 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONIST MERCK & CO INC (US) 1998-07-08 EP disclosed
EP-0833637-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONIST Merck & Co., Inc. (US) 1998-04-08 EP disclosed
US-5661163-A TREATMENT OF BENIGN PROSTATIC HYPERPLASIA MERCK & CO., INC. (US) 1997-08-26 US disclosed
WO-1996040136-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONIST MERCK & CO., INC. (US) 1996-12-19 WO disclosed