SCHEMBL7473970

SCHEMBL7473970

COC(=O)[C@H](C)NC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADCY8 P40145 1/20 0.42
IDO1 P14902 2/20 0.42
CBX7 O95931 2/20 0.41
CDYL Q9Y232 2/20 0.41
SNRNP200 O75643 1/20 0.39
AKR1C3 P42330 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.37
MGAM O43451 1/20 0.37
HTR1A P08908 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
CDYL2 Q8N8U2 1/20 0.36
CDY1; CDY1B Q9Y6F8 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
SCHEMBL7466055 0.78 AKR1C3 (0.45) ADCY8IDO1CBX7CDYLAKR1C3
SCHEMBL2497477 0.78 KMT2A (0.42) ADCY8IDO1CBX7CDYLSNRNP200
SCHEMBL2492996 0.78 KMT2A (0.42) ADCY8IDO1CBX7CDYLSNRNP200
SCHEMBL8593816 0.77 BRD4 (0.48) ADCY8IDO1CBX7CDYLSNRNP200
SCHEMBL7477321 0.77 IDO1 (0.42) ADCY8IDO1CBX7CDYLSNRNP200
SCHEMBL2501749 0.77 KMT2A (0.43) ADCY8IDO1CBX7CDYLSNRNP200
SCHEMBL8592741 0.76 ADCY8 (0.50) ADCY8IDO1CBX7CDYLAKR1C3
SCHEMBL7471456 0.76 BRD4 (0.49) ADCY8IDO1AKR1C3MGAMHTR1A
SCHEMBL9283365 0.76 BRD4 (0.49) ADCY8IDO1AKR1C3MGAMHTR1A
SCHEMBL7471316 0.76 BRD4 (0.49) ADCY8IDO1AKR1C3MGAMHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687251-B1 1,3-DIHYDROINDOL-2-ONE DERIVATIVES SUBSTITUTED IN POSITION 3 BY A NITROGEN GROUP AS VASOPRESSIN AND/OR OCYTOCINE AGONISTS AND/OR ANTAGONISTS SANOFI SYNTHELABO (FR) 2002-02-27 EP disclosed
US-5594023-A 1,3-dihydroindol-2-one derivatives substituted in the 3-position by a nitrogen-containing group, their preparation and the pharmaceutical compositions in which they are present SANOFI (FR) 1997-01-14 US disclosed
WO-1995018105-A1 1,3-DIHYDROINDOL-2-ONE DERIVATIVES SUBSTITUTED IN POSITION 3 BY A NITROGEN GROUP AS VASOPRESSIN AND/OR OCYTOCINE AGONISTS AND/OR ANTAGONISTS SANOFI (FR) 1995-07-06 WO disclosed