SCHEMBL7472348

SCHEMBL7472348

CCNC1(c2ccccc2Cl)C(=O)N(Cc2ccc(C(=O)O)cc2)c2ccc(Cl)cc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
SCN9A Q15858 2/20 0.43
PTGDR2 Q9Y5Y4 6/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42

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
SCHEMBL7466211 0.88 HDAC1 (0.45) TP53HDAC1HDAC6SCN9APTGDR2
SCHEMBL7470112 0.86 HDAC1 (0.43) TP53HDAC1HDAC6SCN9APTGDR2
SCHEMBL7477811 0.86 HDAC1 (0.43) TP53HDAC1HDAC6SCN9APTGDR2
SCHEMBL7460259 0.81 SCN9A (0.46) TP53HDAC1HDAC6SCN9APTGDR2
SCHEMBL7470580 0.81 PTGDR2 (0.48) TP53HDAC1HDAC6SCN9APTGDR2
SCHEMBL7474345 0.76 PTGDR2 (0.45) TP53SCN9APTGDR2MAPTSMN1; SMN2
SCHEMBL8590046 0.76 MEN1 (0.40) TP53PTGDR2ALDH1A1MAPTSMN1; SMN2
SCHEMBL7476933 0.75 PTGDR2 (0.46) TP53SCN9APTGDR2MAPTSMN1; SMN2
SCHEMBL8594361 0.74 POLB (0.41) ALDH1A1MAPTSMN1; SMN2
SCHEMBL8590049 0.73 PTGDR2 (0.34) HDAC1HDAC6PTGDR2

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 4 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
EP-0687251-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) 1995-12-20 EP 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