SCHEMBL7470216

SCHEMBL7470216

CNC1(c2ccccc2Cl)C(=O)N(S(=O)(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2)c2ccc(Cl)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
KMT2A Q03164 3/20 0.45
GPR27 Q9NS67 7/20 0.44
AVPR2 P30518 2/20 0.44
MEN1 O00255 2/20 0.43
NR1I2 O75469 1/20 0.43
RORA P35398 1/20 0.43
RORC P51449 1/20 0.43
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
RORB Q92753 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL7470710 0.86 GAA (0.46) GAAKMT2AMEN1ALDH1A1POLB
SCHEMBL7467489 0.83 AVPR1B (0.39) KMT2AAVPR2MEN1POLB
SCHEMBL7466135 0.81 PARL (0.38) KMT2AMEN1ALDH1A1POLB
SCHEMBL7466648 0.80 NPSR1 (0.45) GAAKMT2AGPR27MEN1ALDH1A1
SCHEMBL7475898 0.76 TRPV4 (0.38) GAAKMT2AGPR27AVPR2MEN1
SCHEMBL7461629 0.76 NPSR1 (0.43) GAAKMT2AGPR27MEN1ALDH1A1
SCHEMBL8589677 0.76 AVPR1B (0.40) GAAAVPR2KDM4E
SCHEMBL7475739 0.76 NPSR1 (0.38) GAAALDH1A1LMNANPSR1
SCHEMBL7471149 0.76 NPSR1 (0.39) GAAAVPR2ALDH1A1LMNATP53
SCHEMBL8593348 0.76 NPSR1 (0.39) GAAAVPR2ALDH1A1LMNAKDM4E

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-5773612-A VASOPRESSIN OR OXYTOCIN RECEPTORS SANOFI (FR) 1998-06-30 US 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