SCHEMBL7323990

SCHEMBL7323990

CC(CC(=O)OC(=O)C(F)(F)F)N1C(=O)c2cc(CCCCCNC(=N)N)ccc2N(Cc2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 13/20 0.33
TP53 P04637 3/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPY4R P50391 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL7333262 0.92 HDAC3 (0.35) MDM2TP53POLBSMN1; SMN2ALDH1A1
SCHEMBL7329501 0.92 MDM2 (0.34) MDM2
SCHEMBL7324133 0.91 MDM2 (0.32) MDM2KMT2A
SCHEMBL7331102 0.91
Trifluoroacetic Acid SCHEMBL7323985 0.91 MDM2 (0.35) MDM2TP53NPY4RALDH1A1HPGD
SCHEMBL7322927 0.90 ALDH1A1 (0.30) ALDH1A1KMT2AMAPT
SCHEMBL7360313 0.90 MDM2 (0.35) MDM2TP53ALDH1A1KMT2A
SCHEMBL7331809 0.89 MDM2 (0.33) MDM2TP53
SCHEMBL7333410 0.88 MDM2 (0.37) MDM2TP53
SCHEMBL7333082 0.87 MDM2 (0.36) MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5674863-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5674865-A BENZODIAZEPINEDIONE DERIVATIVE; FIBRINOGIN BINDING INHIBITOR GENENTECH, INC. (US) 1997-10-07 US disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0610334-B1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII B III A RECEPTOR GENENTECH INC (US) 1996-01-24 EP disclosed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 EP disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 WO disclosed